Name stringlengths 14 548 | Synonym stringlengths 14 790 ⌀ | CAS RN stringlengths 7 12 | Y int64 0 1 | Detailed Page stringlengths 57 580 | Evidence stringlengths 40 2.31k ⌀ | OECD TG 404 stringclasses 1
value | Data Source stringclasses 34
values | Frequency int64 1 6 | SMILES stringlengths 2 255 | SMILES URL stringlengths 45 101 | SMILES Source stringclasses 4
values | Canonical SMILES stringlengths 2 248 | Split stringclasses 1
value |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
JP_CHRIP:
methyl chloroformate
NZ_CCID:
Methyl chloroformate | JP_CHRIP:
Carbonochloridic acid, methyl ester
chloroformic acid methyl ester
Methoxycarbonyl chloride
Methyl chlorocarbonate | 79-22-1 | 1 | JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/08-mhlw-0008e.html
NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/61ECBDB5-56E6-404E-956B-B219B79EC6DD | JP_CHRIP:
The substance was classified into Category 1 since the substance caused damage to skin, and its contact to eyes and skin was highly irritating or corrosive in guinea pig studies (PATTY (5th 2001)). Similarly, the substance is reported to be a highly corrosive irritant according to HSDB (2002); and it is rated... | null | JP_CHRIP, NZ_CCID | 2 | COC(=O)Cl | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.836I | J-GLOBAL | COC(=O)Cl | Train |
NZ_CCID:
Isobutyryl chloride | null | 79-30-1 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/02A72A25-6955-4F07-8B2E-D35D8101D981 | NZ_CCID:
Skin Irritation
UN #2353 UN CLASS: 8; PG II
Eye Irritation
R PHRASE: R 35 [Company Data]
UN #2353 UN CLASS: 8 PG II | null | NZ_CCID | 1 | CC(C)C(=O)Cl | https://pubchem.ncbi.nlm.nih.gov/compound/62325 | PubChem | CC(C)C(=O)Cl | Train |
EU_REACH:
2-methylpropanoic acid
JP_CHRIP:
2-Methylpropionic acid
NZ_CCID:
Propanoic acid, 2-methyl- | JP_CHRIP:
2-Methylpropanoic acid
Dimethylacetic acid
Propionic acid, 2-methyl-
NZ_CCID:
2-Methylpropanoic acid, 2-Methylpropionic acid, Dimethylacetic acid, I-Butyric acid, Isobutanoic acid, Isobutyric acid, Isopropylformic acid, iso-Butyric acid | 79-31-2 | 1 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/14591/7/4/2/?documentUUID=a09fc7c1-3520-4e26-9032-37c607c255e0
JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/09-mhlw-0073e.html
NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/F35B0... | EU_REACH:
Experimental study (OECD TG 404, GLP)
JP_CHRIP:
Based on a result of "caused some necrosis within 24-hour" in skin irritation test (open) with rabbits (PATTY (5th, 2001)) and a report of corrosive in rabbit test (IUCLID (2000)), the substance was classified into Category 1.
NZ_CCID:
Skin Irritation
SPECIES:... | Provided | EU_REACH, JP_CHRIP, NZ_CCID | 3 | CC(C)C(=O)O | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.840G | J-GLOBAL | CC(C)C(=O)O | Train |
EU_REACH:
(2S)-2-hydroxypropanoic acid
JP_CHRIP:
L-Lactic acid
NZ_CCID:
(S)-2-Hydroxypropanoic acid | JP_CHRIP:
(S)-2-Hydroxypropionic acid
DL-lactic acid
L-Lactic acid | 79-33-4 | 1 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/14252/7/4/2/?documentUUID=c84f268b-9269-4502-b486-f5ed9ee9b3ad
JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/16-mhlw-0140e.html
NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/A3337... | EU_REACH:
Experimental study (OECD TG 404, GLP)
JP_CHRIP:
Since a dermal irritation test (OECD TG 404) using rabbits with this substance indicated severe irritation, and it was corrosive (SIAP (2011)), it was classified in Category 1.
NZ_CCID:
Skin Irritation
SPECIES: rabbit
RESULT: corrosive
RELIABILITY (KLIMISCH SC... | Provided | EU_REACH, JP_CHRIP, NZ_CCID | 3 | C[C@H](O)C(=O)O | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J9.134K | J-GLOBAL | C[C@H](O)C(=O)O | Train |
JP_CHRIP:
dichloroacetyl chloride
NZ_CCID:
Dichloroacetyl chloride | JP_CHRIP:
Dichloroacetyl chloride | 79-36-7 | 1 | JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/08-mhlw-0073e.html
NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/31A12432-753D-41E2-89CE-B6E878A14A69 | JP_CHRIP:
It has been documented that in an irritation test using rabbits in which 2 mg of the substance was applied to the skin for 24 hours, the substance was severely irritating (RTECS (2007)). Also, in cases of humans, it has been documented to be a strong irritant to skin and eyes (HSDB (2003)). Thus, the substanc... | null | JP_CHRIP, NZ_CCID | 2 | ClC(Cl)C(=O)Cl | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.841E | J-GLOBAL | O=C(Cl)C(Cl)Cl | Train |
NZ_CCID:
Oxalyl chloride | null | 79-37-8 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/9B6BA50A-3539-4AC1-9EB6-24FC5DD1EE8E | NZ_CCID:
Skin Irritation
R PHRASE: R 34 [Company Data]
Eye Irritation
R PHRASE: R 34 [Company Data] | null | NZ_CCID | 1 | C(=O)(C(=O)Cl)Cl | https://pubchem.ncbi.nlm.nih.gov/compound/65578 | PubChem | O=C(Cl)C(=O)Cl | Train |
JP_CHRIP:
Methacrylamide | JP_CHRIP:
2-Methylprop-2-enamide | 79-39-0 | 0 | JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/10-mhlw-0071e.html | JP_CHRIP:
There were two test data in conformity with OECD TG 404 and GLP. In the first test, slight erythema in all 3 rabbits was reported after patch removal, but symptoms were reversible after 24 hours. The primary irritation index score was 0.0 and resulted as "not irritating" (SIDS (Access on Jul. 2010)). In the s... | Provided | JP_CHRIP | 1 | CC(=C)C(=O)N | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J38.885H | J-GLOBAL | C=C(C)C(N)=O | Train |
AU_HCIS:
methacrylic acid
JP_CHRIP:
Methacrylic acid
NZ_CCID:
2-Propenoic acid, 2-methyl- (stabilised), (methacrylic acid) | AU_HCIS:
2-methylpropenoic acid
2-Propenoic acid, 2-methyl-
JP_CHRIP:
2-Methylpropenoic acid
2-Prop-2-enoic acid
alpha-Methylacrylic acid
NZ_CCID:
2-Methyl-2-propenoic acid, 2-Methylacrylic acid, 2-Methylpropenoic acid, 2-Propenoic acid, 2-methyl-, Methacrylic Acid, alpha-Methylacrylic acid | 79-41-4 | 1 | AU_HCIS: http://hcis.safeworkaustralia.gov.au/HazardousChemical/Details?chemicalID=2842
JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/17-mhlw-2035e.html
NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/21EA3B75-4390-4764-85E5-6C6D9907EFD5 | JP_CHRIP:
There is a report that in a skin irritation test with rabbits (compliant with Confirmation test in the US Department of Transportation Packing Group classification), corrosivity was observed on observation immediately after a test in which undiluted liquid of this substance was openly applied for 3 minutes, f... | null | AU_HCIS, JP_CHRIP, NZ_CCID | 3 | CC(=C)C(=O)O | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.843A | J-GLOBAL | C=C(C)C(=O)O | Train |
NZ_CCID:
2-Mercaptopropionic acid | NZ_CCID:
thiolactic acid | 79-42-5 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/B232771A-FBBA-499E-AC11-11F62679AF5C | NZ_CCID:
Skin Irritation
R PHRASE: R 34 [Company Data]
Eye Irritation
R PHRASE: R 34 [Company Data] | null | NZ_CCID | 1 | CC(C(=O)O)S | https://pubchem.ncbi.nlm.nih.gov/compound/62326 | PubChem | CC(S)C(=O)O | Train |
JP_CHRIP:
Dichloroacetic acid
KR_NCIS:
Dichloroacetic acid ; DCA
NZ_CCID:
Dichloroacetic acid
US_HSDB:
Dichloroacetic acid | JP_CHRIP:
2,2-Dichloroacetic acid
Bichloroacetic acid
DCA
Dichlorethanoic acid
KR_NCIS:
DCA | 79-43-6 | 1 | JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/15-mhlw-0043e.html
KR_NCIS: https://ncis.nier.go.kr/en/main.do, button "Hazardous chemical substances"
NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/5CB9355F-A549-41F6-9539-363700D75AB5
US_HSDB: https://pubch... | JP_CHRIP:
It is written that irritation was observed after the application of 10 mg this substance in rabbits (ACGIH (7th, 2005)) and that severe irritation was found after the 24-hour application of 2 mg this substance (ACGIH (7th, 2005)). Moreover, it is not specific information, but it is written that this substance... | null | JP_CHRIP, KR_NCIS, NZ_CCID, US_HSDB | 4 | OC(=O)C(Cl)Cl | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.834G | J-GLOBAL | O=C(O)C(Cl)Cl | Train |
EU_REACH:
(±)-dihydro-3-hydroxy-4,4-dimethylfuran-2(3H)-one | null | 79-50-5 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/16642/7/4/2/?documentUUID=81b9200f-89a9-4c5e-b6fb-6ba65fd0033b | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC1(COC(=O)C1O)C | https://pubchem.ncbi.nlm.nih.gov/compound/989 | PubChem | CC1(C)COC(=O)C1O | Train |
NZ_CCID:
Pempidine | null | 79-55-0 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/154D9707-676F-4E30-9873-F340AD3656A9 | NZ_CCID:
Skin Irritation
R PHRASE: R 34 [CHEMWATCH]
Eye Irritation
R PHRASE: R 41 [CHEMWATCH] | null | NZ_CCID | 1 | CC1(CCCC(N1C)(C)C)C | https://pubchem.ncbi.nlm.nih.gov/compound/6603 | PubChem | CN1C(C)(C)CCCC1(C)C | Train |
EU_REACH:
2-Naphthalenecarboxamide, N,N'-(2,5-dimethyl-1,4-phenylene)bis[4-[2-(5-chloro-2-methylphenyl)diazenyl]-3-hydroxy- | null | 79665-24-0 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/10328/7/4/2/?documentUUID=9f9c4352-bd09-478d-bb5e-effb60cf28af | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC1=C(C=C(C=C1)Cl)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)NC4=CC(=C(C=C4C)NC(=O)C5=CC6=CC=CC=C6C(=C5O)N=NC7=C(C=CC(=C7)Cl)C)C)O | https://pubchem.ncbi.nlm.nih.gov/compound/174176 | PubChem | Cc1ccc(Cl)cc1N=Nc1c(O)c(C(=O)Nc2cc(C)c(NC(=O)c3cc4ccccc4c(N=Nc4cc(Cl)ccc4C)c3O)cc2C)cc2ccccc12 | Train |
KR_NCIS:
3-Dodecyl-1-(2,2,6,6-tetramethyl-4-piperidinyl)-2,5-pyrrolidinedione | KR_NCIS:
2,5-Pyrrolidinedione, 3-dodecyl-1-(2,2,6,6-tetramethyl-4-piperidinyl)-; 2-Dodecyl-N-(2,2,6,6-tetramethyl-4-piperidinyl)succinimide; 3-Dodecy-1-(2,2,6,6-tetramethyl-4-piperidinyl)-2,5-pyrrolidinedione; 3-Dodecyl-1-(2,2,6,6-tetramethyl-4-piperidinyl)-2,5-pyrrolidinedione; 3-Dodecyl-1-(2,2,6,6-tetramethylpiperidi... | 79720-19-7 | 1 | KR_NCIS: https://ncis.nier.go.kr/en/main.do, button "Hazardous chemical substances" | null | null | KR_NCIS | 1 | CCCCCCCCCCCCC1CC(=O)N(C1=O)C2CC(NC(C2)(C)C)(C)C | https://pubchem.ncbi.nlm.nih.gov/compound/174179 | PubChem | CCCCCCCCCCCCC1CC(=O)N(C2CC(C)(C)NC(C)(C)C2)C1=O | Train |
JP_CHRIP:
Camphene (mixed optical isomers) | JP_CHRIP:
2,2-Dimethyl-3-methylene-norborane
2,2-Dimethyl-3-methylenebicyclo(2.2.1)heptane
Bicyclo(2.2.1)heptane, 2,2-dimethyl-3-methylene
Bicyclo[2.2.1]heptane, 2,2-dimethyl-3-methylene-
Camphene | 79-92-5 | 0 | JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/12-mhlw-0029e.html | JP_CHRIP:
It was classified as "Not classified" because it was judged as no irritation in a test by a 4-hour application to the rabbit skin (OECD TG404, GLP) (SIDS (Access on June 2012)). Besides, it is reported that it was slightly irritating after a 24-hour occlusive application of undiluted this substance to the rab... | Provided | JP_CHRIP | 1 | CC1(C)C2CCC(C2)C1=C | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J39.020H | J-GLOBAL | C=C1C2CCC(C2)C1(C)C | Train |
EU_REACH:
2,4-diazatetracyclo[12.4.0.0²,⁶.0⁷,¹²]octadeca-1(18),3,7,9,11,14,16-heptaen-3-amine | null | 80012-43-7 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/25792/7/4/2/?documentUUID=d0ac4fe9-387a-4fbb-9ea5-a1289b3a52e5 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C1C2C3=CC=CC=C3CC4=CC=CC=C4N2C(=N1)N | https://pubchem.ncbi.nlm.nih.gov/compound/3241 | PubChem | NC1=NCC2c3ccccc3Cc3ccccc3N12 | Train |
EU_REACH:
4,4'-isopropylidenedicyclohexanol | null | 80-04-6 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/11451/7/4/2/?documentUUID=83a740e6-3d62-4227-b746-069d620c6c67 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC(C)(C1CCC(CC1)O)C2CCC(CC2)O | https://pubchem.ncbi.nlm.nih.gov/compound/94932 | PubChem | CC(C)(C1CCC(O)CC1)C1CCC(O)CC1 | Train |
JP_CHRIP:
Bisphenol A | JP_CHRIP:
2,2-bis(4-hydroxyphenyl)propane
4,4'-(1-Methylethylidene)bisphenol
4,4'-isopropylidenediphenol
Bisphenol A
4,4'-(Propane-2,2-diyl)diphenol | 80-05-7 | 0 | JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/16-mhlw-0123e.html | JP_CHRIP:
Because in the result of a skin irritation test using rabbits (4-hour application, OECD TG 404), skin irritation was not observed (DFGOT suppl (2011), EU-RAR (2010)), it was classified as "Not classified." | Provided | JP_CHRIP | 1 | CC(C)(c1ccc(O)cc1)c1ccc(O)cc1 | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.531I | J-GLOBAL | CC(C)(c1ccc(O)cc1)c1ccc(O)cc1 | Train |
JP_CHRIP:
Dichlorodiphenylsilane
NZ_CCID:
Diphenyldichlorosilane | JP_CHRIP:
Dichlorodiphenylsilane | 80-10-4 | 1 | JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/12-mhlw-0052e.html
NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/DE98D35C-F618-47D0-83BE-F9D203A38109 | JP_CHRIP:
It is described that this substance is a corrosive chemical, contact with skin can cause severe burns leading to permanent damage, and after dermal exposure, dermatitis (red, inflamed skin), severe burns, pain, and shock occur (HSDB (2010)). And it is described that an application of chlorosilanes to rabbits ... | null | JP_CHRIP, NZ_CCID | 2 | Cl[Si](Cl)(c1ccccc1)c1ccccc1 | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J54.323C | J-GLOBAL | Cl[Si](Cl)(c1ccccc1)c1ccccc1 | Train |
AU_HCIS:
α,α-dimethylbenzyl hydroperoxide
JP_CHRIP:
1-Methyl-1-phenylethyl hydroperoxide
NZ_CCID:
Hydroperoxide, 1-methyl-1-phenylethyl 90-98%, cumene 2-10% | AU_HCIS:
cumene hydroperoxide
Hydroperoxide, 1-methyl-1-phenylethyl
JP_CHRIP:
2-Hydroperoxy-2-phenylpropane
1-methyl-1-phenylethyl hydroperoxide
2-Phenylpropan-2-yl hydroperoxide
alpha,alpha-Dimethylbenzyl hydroperoxide
cumene hydroperoxide
Cumyl hydroperoxide
Hydroperoxide, 1-methyl-1-phenylethyl
NZ_CCID:
Cumene hyd... | 80-15-9 | 1 | AU_HCIS: http://hcis.safeworkaustralia.gov.au/HazardousChemical/Details?chemicalID=4748
JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/17-mhlw-2060e.html
NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/8046C3B7-4928-4A17-89BA-C7E54D1BC850 | JP_CHRIP:
As for skin sensitization tests with rabbits, there is a report that severe irritation and damages were found (DFGOT Vol. 3 (1992)), and a description that severe irritation or corrosivity were observed (PATTY (6th, 2012)), therefore, it was classified in Category 1. Besides, this substance was classified as ... | null | AU_HCIS, JP_CHRIP, NZ_CCID | 3 | CC(C)(OO)c1ccccc1 | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.835E | J-GLOBAL | CC(C)(OO)c1ccccc1 | Train |
JP_CHRIP:
4-tert-Pentylphenol | null | 80-46-6 | 1 | JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/17-mhlw-0029e.html | JP_CHRIP:
Based on descriptions that this substance was corrosive to the skin (EPA Pesticide (2005)), and that this substance was an irritant of Category I (HSDB (Access on August 2017)), it was classified in Category 1. | null | JP_CHRIP | 1 | CCC(C)(C)c1ccc(O)cc1 | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.250A | J-GLOBAL | CCC(C)(C)c1ccc(O)cc1 | Train |
EU_REACH:
5-methyl-2-(1-methylbutyl)-5-propyl-1,3-dioxane | null | 80480-24-6 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/22456/7/4/2/?documentUUID=c8c446cf-9483-4031-b80c-1a4e54914855 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CCCC(C)C1OCC(CO1)(C)CCC | https://pubchem.ncbi.nlm.nih.gov/compound/166523 | PubChem | CCCC(C)C1OCC(C)(CCC)CO1 | Train |
EU_REACH:
Resin acids and rosin acids, ester with glycerol | null | 8050-31-5 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/15312/7/4/2/?documentUUID=61a6c1d6-7bea-44e2-8d21-71036db88b2e | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC(C)C1=CC2=CC[C@@H]3[C@@]([C@H]2CC1)(CCC[C@@]3(C)C(=O)OCC(CO)O)C | https://pubchem.ncbi.nlm.nih.gov/compound/11852355 | PubChem | CC(C)C1=CC2=CC[C@@H]3[C@](C)(CCC[C@@]3(C)C(=O)OCC(O)CO)[C@H]2CC1 | Train |
NZ_CCID:
2-Bromobutyric acid | null | 80-58-0 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/9F54251B-45DA-4F47-9D00-6BBA0713F35D | NZ_CCID:
Skin Irritation
R PHRASE: R 34 [Company Data]
Eye Irritation
R PHRASE: R 34 [Company Data] | null | NZ_CCID | 1 | CCC(C(=O)O)Br | https://pubchem.ncbi.nlm.nih.gov/compound/6655 | PubChem | CCC(Br)C(=O)O | Train |
EU_REACH:
2-[(1E)-2-(2-methoxy-5-nitrophenyl)diazen-1-yl]-N-(2-methoxyphenyl)-3-oxobutanamide | null | 80675-49-6 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/10476/7/4/2/?documentUUID=b30f5356-3971-4b08-a577-db20240f2d20 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC(=O)C(C(=O)NC1=CC=CC=C1OC)N=NC2=C(C=CC(=C2)[N+](=O)[O-])OC | https://pubchem.ncbi.nlm.nih.gov/compound/102295954 | PubChem | COc1ccc([N+](=O)[O-])cc1N=NC(C(C)=O)C(=O)Nc1ccccc1OC | Train |
NZ_CCID:
1,1,3,3-tetramethylguanidine | NZ_CCID:
Guanidine, N,N,N',N'-tetramethyl- | 80-70-6 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/E1104A4D-A044-4A1C-848A-A6DE4F85F13E | NZ_CCID:
Skin Irritation
R PHRASE: R 34 [Company Data]
Eye Irritation
R PHRASE: R 34 [Company Data] | null | NZ_CCID | 1 | CN(C)C(=N)N(C)C | https://pubchem.ncbi.nlm.nih.gov/compound/66460 | PubChem | CN(C)C(=N)N(C)C | Train |
EU_REACH:
1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluorooctane | null | 80793-17-5 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/7612/7/4/2/?documentUUID=2cb7251a-0fc2-4c16-88aa-6ed513375f1a | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F | https://pubchem.ncbi.nlm.nih.gov/compound/2776163 | PubChem | CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F | Train |
EU_REACH:
2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide | null | 81-13-0 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/14227/7/4/2/?documentUUID=55f4d317-ac75-44ca-839b-a685c2fed021 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC(C)(CO)[C@H](C(=O)NCCCO)O | https://pubchem.ncbi.nlm.nih.gov/compound/131204 | PubChem | CC(C)(CO)[C@@H](O)C(=O)NCCCO | Train |
EU_REACH:
1,3-dichloro-2-(dichloromethyl)benzene | null | 81-19-6 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/12005/7/4/2/?documentUUID=3248af29-9962-4b0a-808e-17c3ae27591a | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C1=CC(=C(C(=C1)Cl)C(Cl)Cl)Cl | https://pubchem.ncbi.nlm.nih.gov/compound/6671 | PubChem | Clc1cccc(Cl)c1C(Cl)Cl | Train |
EU_REACH:
methyl dihydrogen phosphate | null | 812-00-0 | 1 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/24818/7/4/2/?documentUUID=bcba15ef-7482-4eb6-afb0-9ae8209b0d91 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | COP(=O)(O)O | https://pubchem.ncbi.nlm.nih.gov/compound/13130 | PubChem | COP(=O)(O)O | Train |
EU_REACH:
2-[4-methyl-5-oxo-4-(propan-2-yl)-4,5-dihydro-1H-imidazol-2-yl]pyridine-3-carboxylic acid
JP_CHRIP:
(RS)-2-(4-Isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl)nicotinic acid (synonym: imazapyr) | null | 81334-34-1 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/21966/7/4/2/?documentUUID=17d6089d-d9d5-4e7f-8149-61bfa83ad3aa
JP_CHRIP: https://www.nite.go.jp/chem/ghs/21-meti-0025.html | EU_REACH:
Experimental study (OECD TG 404, GLP)
JP_CHRIP:
【分類根拠】
（１）、（２）より、区分に該当しない。
【根拠データ】
（１）ウサギ（n=3）を用いた皮膚刺激性試験（OECD TG 404、GLP、半閉塞、4時間適用、72時間観察）において、皮膚刺激性はみられなかった（紅斑・痂皮スコア：0/0/0、浮腫スコア：0/0/0）との報告がある（REACH登録情報 (Accessed May 2021)）。
（２）ウサギ（n=6）を用いた皮膚刺激性試験（72時間観察）において、本物質を有傷皮膚、無傷皮膚に適用したところ、有傷皮膚では24時間後に紅斑がみられたが、72時間以... | Provided | EU_REACH, JP_CHRIP | 2 | CC(C)C1(C)N=C(NC1=O)c1ncccc1C(=O)O | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J43.085D | J-GLOBAL | CC(C)C1(C)N=C(c2ncccc2C(=O)O)NC1=O | Train |
NZ_CCID:
Phosphine oxide, tributyl- | null | 814-29-9 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/444CA1FD-703C-430C-AB90-D3B753F8B0A1 | NZ_CCID:
Skin Irritation
R PHRASE: R 34 [CHEMWATCH]
Eye Irritation
R PHRASE: R 41 [CHEMWATCH] | null | NZ_CCID | 1 | CCCCP(=O)(CCCC)CCCC | https://pubchem.ncbi.nlm.nih.gov/compound/13138 | PubChem | CCCCP(=O)(CCCC)CCCC | Train |
NZ_CCID:
Acryloyl chloride
US_HSDB:
Acrylyl chloride | null | 814-68-6 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/927AF785-FB58-45D9-B434-B1E15A9469C4
US_HSDB: https://pubchem.ncbi.nlm.nih.gov/source/hsdb/6330 | NZ_CCID:
Skin Irritation
R PHRASE: R 35 [Company Data]
Eye Irritation
R PHRASE: R 35 [Company Data] | null | NZ_CCID, US_HSDB | 2 | C=CC(=O)Cl | https://pubchem.ncbi.nlm.nih.gov/compound/13140 | PubChem | C=CC(=O)Cl | Train |
EU_REACH:
4-({5-cyano-4-methyl-6-[(4-sulfophenyl)amino]pyridin-2-yl}amino)benzene-1-sulfonic acid | null | 815676-09-6 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/22281/7/4/2/?documentUUID=c8349557-747d-4810-bec6-ebb41fb62477 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC1=CC(=NC(=C1C#N)NC2=CC=C(C=C2)S(=O)(=O)O)NC3=CC=C(C=C3)S(=O)(=O)O | https://pubchem.ncbi.nlm.nih.gov/compound/11167833 | PubChem | Cc1cc(Nc2ccc(S(=O)(=O)O)cc2)nc(Nc2ccc(S(=O)(=O)O)cc2)c1C#N | Train |
EU_REACH:
(2S,4S)-4-(phenylsulfanyl)pyrrolidine-2-carboxylic acid | null | 81653-77-2 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/1157/7/4/2/?documentUUID=b46de39b-cf30-4686-8289-615dfa0648dc | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C1[C@@H](CN[C@@H]1C(=O)O)SC2=CC=CC=C2 | https://pubchem.ncbi.nlm.nih.gov/compound/11379084 | PubChem | O=C(O)[C@@H]1C[C@H](Sc2ccccc2)CN1 | Train |
EU_REACH:
4-methyldec-3-en-5-ol | null | 81782-77-6 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/12744/7/4/2/?documentUUID=e7f65251-245d-4c40-849c-1028db866384 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CCCCCC(/C(=C/CC)/C)O | https://pubchem.ncbi.nlm.nih.gov/compound/6441135 | PubChem | CC/C=C(\C)C(O)CCCCC | Train |
EU_REACH:
2-[(1E)-2-(2-methoxyphenyl)diazen-1-yl]-3-oxo-N-(2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl)butanamide | null | 82199-12-0 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/5446/7/4/2/?documentUUID=98595a51-8f6b-4a24-9748-0bbe11174160 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC(=O)C(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)N=NC3=CC=CC=C3OC | https://pubchem.ncbi.nlm.nih.gov/compound/174265 | PubChem | COc1ccccc1N=NC(C(C)=O)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 | Train |
EU_REACH:
1-hydroxy-1,2-dihydropyridin-2-one | null | 822-89-9 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/26617/7/4/2/?documentUUID=a85f74e3-7b99-4640-ba82-ccadce8bd02b | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C1=CC(=O)N(C=C1)O | https://pubchem.ncbi.nlm.nih.gov/compound/69975 | PubChem | O=c1ccccn1O | Train |
EU_REACH:
(4E)-3-methylcyclopentadec-4-en-1-one; (5E)-3-methylcyclopentadec-5-en-1-one; (5Z)-3-methylcyclopentadec-5-en-1-one | null | 82356-51-2 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/16261/7/4/2/?documentUUID=cbb227f1-859f-4e56-87bc-53e7f494d013 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C/C/1=C/CCCCCCCCCCCCC1=O | https://pubchem.ncbi.nlm.nih.gov/compound/92043557 | PubChem | C/C1=C/CCCCCCCCCCCCC1=O | Train |
NZ_CCID:
3-Bromobenzyl bromide | null | 823-78-9 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/69FA01C0-4A55-441B-AF98-675925FFB27E | NZ_CCID:
Skin Irritation
R PHRASE: R 34 [Company Data]
Eye Irritation
R PHRASE: R 34 [Company Data] | null | NZ_CCID | 1 | C1=CC(=CC(=C1)Br)CBr | https://pubchem.ncbi.nlm.nih.gov/compound/69979 | PubChem | BrCc1cccc(Br)c1 | Train |
NZ_CCID:
Dichlorophenylphosphine oxide | null | 824-72-6 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/78E2D2DC-D3EE-47D2-90BF-C77198CAC8FC | NZ_CCID:
Skin Irritation
R PHRASE: R 34 [CHEMWATCH]
Eye Irritation
R PHRASE: R 41 [CHEMWATCH] | null | NZ_CCID | 1 | C1=CC=C(C=C1)P(=O)(Cl)Cl | https://pubchem.ncbi.nlm.nih.gov/compound/69990 | PubChem | O=P(Cl)(Cl)c1ccccc1 | Train |
NZ_CCID:
3-Methoxybenzyl chloride | null | 824-98-6 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/8D69766A-B0F4-4FE2-A420-63EB15E4C4F9 | NZ_CCID:
Skin Irritation
R PHRASE: R 34 [Company Data]
Eye Irritation
R PHRASE: R 34 [Company Data] | null | NZ_CCID | 1 | COC1=CC=CC(=C1)CCl | https://pubchem.ncbi.nlm.nih.gov/compound/69994 | PubChem | COc1cccc(CCl)c1 | Train |
EU_REACH:
4-chlorobutyl 3-chloropropanoate | null | 82530-64-1 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/33473/7/4/2/?documentUUID=7a562632-4f5b-40cb-afd5-1f69e1f2afa1 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C(CCCl)COC(=O)CCCl | https://pubchem.ncbi.nlm.nih.gov/compound/11275655 | PubChem | O=C(CCCl)OCCCCCl | Train |
EU_REACH:
4-(4-butylphenyl)-4'-ethyl-3-fluoro-1,1'-biphenyl | null | 825633-75-8 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/21007/7/4/2/?documentUUID=45938635-2d93-4d92-a5fa-5435ab0246f1 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CCCCC1=CC=C(C=C1)C2=C(C=C(C=C2)C3=CC=C(C=C3)CC)F | https://pubchem.ncbi.nlm.nih.gov/compound/59734846 | PubChem | CCCCc1ccc(-c2ccc(-c3ccc(CC)cc3)cc2F)cc1 | Train |
JP_CHRIP:
2,2,6,6-Tetramethylpiperidin-4-one
NZ_CCID:
2,2,6,6-Tetramethyl-4-piperidone | JP_CHRIP:
2,2,6,6-Tetramethyl-4-oxopiperidine
4-Piperidinone, 2,2,6,6-tetramethyl- | 826-36-8 | 1 | JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/11-mhlw-0139e.html
NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/0E9138E5-310A-49E1-A6F0-8DDB3429A025 | JP_CHRIP:
On the basis that a test (OECD TG 404) applied 500 mg to rabbit skin for 4 hours observed severe necrosis was discontinued due to severe damages after 24 hours and this substance was assessed as caustic as a result (BUA Report 255 (2006)), it was classified in Category 1.
Furthermore, another test applied 500... | Provided | JP_CHRIP, NZ_CCID | 2 | CC1(C)CC(=O)CC(C)(C)N1 | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J107D | J-GLOBAL | CC1(C)CC(=O)CC(C)(C)N1 | Train |
EU_REACH:
4-(butoxymethyl)-2-methoxyphenol | null | 82654-98-6 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/1538/7/4/2/?documentUUID=b7412d20-feaf-4369-9569-121f177ac77f | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CCCCOCC1=CC(=C(C=C1)O)OC | https://pubchem.ncbi.nlm.nih.gov/compound/5084146 | PubChem | CCCCOCc1ccc(O)c(OC)c1 | Train |
NZ_CCID:
Diphenylcarbamyl chloride | NZ_CCID:
N,N-Diphenylcarbamoyl chloride | 83-01-2 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/442EEC7A-9E19-44F6-BF36-77F987A0694B | NZ_CCID:
Skin Irritation
R PHRASE: R 34 [CHEMWATCH]
Eye Irritation
R PHRASE: R 41[CHEMWATCH] | null | NZ_CCID | 1 | C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)Cl | https://pubchem.ncbi.nlm.nih.gov/compound/65741 | PubChem | O=C(Cl)N(c1ccccc1)c1ccccc1 | Train |
NZ_CCID:
Ethanol, 2-((2-(2-(dimethylamino)ethoxy)ethyl)methylamino)- | NZ_CCID:
2-[(2-[2-(Dimethylamino)ethoxy]ethyl)methylamino]ethanol | 83016-70-0 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/8A074045-DADA-4EF7-A963-FD59ABCF5610 | NZ_CCID:
Skin Irritation
R PHRASE: R 34 [ECB]
Eye Irritation
R PHRASE: R 34 [ECB] | null | NZ_CCID | 1 | CN(C)CCOCCN(C)CCO | https://pubchem.ncbi.nlm.nih.gov/compound/3086157 | PubChem | CN(C)CCOCCN(C)CCO | Train |
EU_REACH:
2-(4-{4-[4-(hydroxydiphenylmethyl)piperidin-1-yl]but-1-yn-1-yl}phenyl)-2-methylpropanoic acid | null | 832088-68-3 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/5722/7/4/2/?documentUUID=48aa4e51-b9f8-4b64-893c-eafb17e46bcc | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC(C)(C1=CC=C(C=C1)C#CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)C(=O)O | https://pubchem.ncbi.nlm.nih.gov/compound/11982796 | PubChem | CC(C)(C(=O)O)c1ccc(C#CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | Train |
JP_CHRIP:
2-ethylamino-4-isopropylamino-6-methylthio-1,3,5-triazine; Ametryn | JP_CHRIP:
1,3,5-Triazine-2,4-diamine, N-ethyl-N'-(1-methylethyl)-6-(methylthio)-
2-ethylamino-4-isopropylamino-6-methylthio-1,3,5-trizaine [synonym:Ametryne]
N-ethyl-N'-isopropyl-6-methylthio-1,3,5-trizaine-2,4-diamine (synonym:2-ethylamino-4-isopropylamino-6-methylthio-1,3,5-trizaine or Ametryne) | 834-12-8 | 0 | JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/20-mhlw-2096e.html | JP_CHRIP:
[Rationale for the Classification]
It was classified as "Not classified" (corresponding to Category 3 in UN GHS classification) from (1) - (4).
[Evidence Data]
(1) In a skin irritation test with rabbits according to EPA OPPTS 870.2500, it was judged as not an irritant (EPA Pesticides RED (2005)).
(2) In eye ... | Provided | JP_CHRIP | 1 | CCNc1nc(NC(C)C)nc(SC)n1 | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.651J | J-GLOBAL | CCNc1nc(NC(C)C)nc(SC)n1 | Train |
EU_REACH:
naphthalene-1,5-diol | null | 83-56-7 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/27320/7/4/2/?documentUUID=742c964e-ba81-4252-a40e-2fbc701bebf0 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C1=CC2=C(C=CC=C2O)C(=C1)O | https://pubchem.ncbi.nlm.nih.gov/compound/6749 | PubChem | Oc1cccc2c(O)cccc12 | Train |
EU_REACH:
4-cyanophenyl 4-{[6-(prop-2-enoyloxy)hexyl]oxy}benzoate | null | 83847-14-7 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/22993/7/4/2/?documentUUID=0ec426dd-564c-43e5-a836-58d277a499e5 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C=CC(=O)OCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N | https://pubchem.ncbi.nlm.nih.gov/compound/640210 | PubChem | C=CC(=O)OCCCCCCOc1ccc(C(=O)Oc2ccc(C#N)cc2)cc1 | Train |
EU_REACH:
methyl 4-[(2,5-dichlorophenyl)carbamoyl]-2-nitrobenzoate | null | 83929-47-9 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/10413/7/4/2/?documentUUID=31bc5513-c8b1-4f6e-8666-16535d2e7d92 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | COC(=O)C1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)Cl)Cl)[N+](=O)[O-] | https://pubchem.ncbi.nlm.nih.gov/compound/3019490 | PubChem | COC(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1[N+](=O)[O-] | Train |
EU_REACH:
1-(DIPHENYLMETHYL)PIPERAZINE | null | 841-77-0 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/24243/7/4/2/?documentUUID=27985cb6-78a0-4a4f-9d26-3f5104ca46b4 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C1CN(CCN1)C(C2=CC=CC=C2)C3=CC=CC=C3 | https://pubchem.ncbi.nlm.nih.gov/compound/70048 | PubChem | c1ccc(C(c2ccccc2)N2CCNCC2)cc1 | Train |
EU_REACH:
2-ethyl-9,10-anthraquinone | null | 84-51-5 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/14500/7/4/2/?documentUUID=1a1592fb-f49c-48aa-8b1d-f2272d637971 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CCC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O | https://pubchem.ncbi.nlm.nih.gov/compound/6772 | PubChem | CCc1ccc2c(c1)C(=O)c1ccccc1C2=O | Train |
EU_REACH:
3-amino-2-chloro-6-methylphenol | null | 84540-50-1 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/21096/7/4/2/?documentUUID=a0360467-cd07-4c16-95f3-27880a3e11fb | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC1=C(C(=C(C=C1)N)Cl)O | https://pubchem.ncbi.nlm.nih.gov/compound/157641 | PubChem | Cc1ccc(N)c(Cl)c1O | Train |
EU_REACH:
3,6-bis(4-methylphenyl)-1H,2H,4H,5H-pyrrolo[3,4-c]pyrrole-1,4-dione | null | 84632-66-6 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/17046/7/4/2/?documentUUID=bca4fda5-5c79-47a9-8a48-69a632377f1e | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC1=CC=C(C=C1)C2=C3C(=C(N2)O)C(=NC3=O)C4=CC=C(C=C4)C | https://pubchem.ncbi.nlm.nih.gov/compound/135565865 | PubChem | Cc1ccc(C2=NC(=O)c3c(-c4ccc(C)cc4)[nH]c(O)c32)cc1 | Train |
JP_CHRIP:
9,10-Anthraquinone | JP_CHRIP:
9,10-Anthracendione
9,10-Anthracenedione
anthraquinone
Diphenyl ketone | 84-65-1 | 0 | JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/12-mhlw-0053e.html | JP_CHRIP:
It was classified as "Not classified" because it was not irritating in a skin irritation test with rabbits (OECD TG 404) (IUCLID (2000)). Besides, it is also reported that it was not irritating in another test by a 24-hour semi-occlusive application of 500 microL or 0.5 g to the rabbit skin (IUCLID (2000)). | Provided | JP_CHRIP | 1 | O=C1c2ccccc2C(=O)c2ccccc12 | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J294A | J-GLOBAL | O=C1c2ccccc2C(=O)c2ccccc21 | Train |
EU_REACH:
(1r,1's,4r,4'r)-4-(4-methylphenyl)-4'-propyl-1,1'-bi(cyclohexane) | null | 84656-75-7 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/21867/7/4/2/?documentUUID=2d87d580-c0c5-4780-b008-3fcf2574eae3 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CCCC1CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)C | https://pubchem.ncbi.nlm.nih.gov/compound/576378 | PubChem | CCCC1CCC(C2CCC(c3ccc(C)cc3)CC2)CC1 | Train |
JP_CHRIP:
Diisobutyl phthalate | JP_CHRIP:
1,2-Benzenedicarboxylic acid, bis-(2-methoxypropyl)ester
Di(isobutyl)-1,2-benzenedicarboxylate
DIBP
Phthalic acic, diisobutyl ester | 84-69-5 | 0 | JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/18-meti-2008e.html | JP_CHRIP:
[Rationale for the Classification]
Based on (1)-(4), it was classified as "Not classified."
[Evidence Data]
(1) There is a report that this substance is not irritating in an in vitro test (OECD TG431, GLP-compliant) (REACH registration dossier (Accessed Dec. 2018)).
(2) There is a report that in a skin irrit... | Provided | JP_CHRIP | 1 | CC(C)COC(=O)c1ccccc1C(=O)OCC(C)C | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.535A | J-GLOBAL | CC(C)COC(=O)c1ccccc1C(=O)OCC(C)C | Train |
JP_CHRIP:
Di-n-butyl phthalate | JP_CHRIP:
1,2-Benzenedicarboxylic acid dibutyl ester
1,2-Benzenedicarboxylic acid, dibutyl ester
Di-n-butyl phthalate
dibutyl benzene-1,2-dicarboxylate
dibutyl phthalate
Dibutyl phthalate; Dibutyl phthalate
Dibutyl-1,2-benzenedicarboxylate | 84-74-2 | 0 | JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/13-mhlw-2015e.html | JP_CHRIP:
It is described in the Initial Risk Assessment Report (NITE, CERI, NEDO, 2005), EU-RAR (2003) that skin irritation was observed, but it is described in EU-RAR (2004) (Addendum to the Environmental Section), which is an addendum to EU-RAR (2003), that a test according to OECD TG404 resulted in no irritation, a... | Provided | JP_CHRIP | 1 | CCCCOC(=O)c1ccccc1C(=O)OCCCC | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.882B | J-GLOBAL | CCCCOC(=O)c1ccccc1C(=O)OCCCC | Train |
EU_REACH:
(1R,2S,5R)-5-methyl-2-(propan-2-yl)-N-[2-(pyridin-2-yl)ethyl]cyclohexanecarboxamide | null | 847565-09-7 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/2631/7/4/2/?documentUUID=63dad0b9-5dc4-4559-b9b8-17ea8b2233ae | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C[C@@H]1CC[C@H]([C@@H](C1)C(=O)NCCC2=CC=CC=N2)C(C)C | https://pubchem.ncbi.nlm.nih.gov/compound/25126651 | PubChem | CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C(=O)NCCc1ccccn1 | Train |
AU_HCIS:
4-nonylphenol, branched
JP_CHRIP:
4-Nonylphenol (branched)
KR_NCIS:
Nonylphenols
NZ_CCID:
Nonylphenol, 4-branched | AU_HCIS:
Phenol, 4-nonyl-, branched
JP_CHRIP:
4-Nonylphenol, branched
Branched 4-nonylphenol
Branched p-nonylphenol; C9 branched alkyl phenol; Nonylphenol; Phenol, 4-nonyl-, branched
KR_NCIS:
4-Nonylphenol, branched; Branched p-nonylphenol; C9 branched alkyl phenolBranched 4-nonylphenol
NZ_CCID:
Monononylphenol, Non... | 84852-15-3 | 1 | AU_HCIS: http://hcis.safeworkaustralia.gov.au/HazardousChemical/Details?chemicalID=3266
JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/10-mhlw-0030e.html
KR_NCIS: https://ncis.nier.go.kr/en/main.do, button "Hazardous chemical substances"
NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-in... | JP_CHRIP:
In the rabbit test (OECD TG 404), occlusive administration of 0.5 ml of test substance caused mild to moderate erythema, and mild to moderate edema at 3 minutes of exposure, moderate erythema and severe edema at 4 hours, subsequently, epidermal necrosis, full-thickness skin necrosis, fissure, exfoliation, ulc... | Provided | AU_HCIS, JP_CHRIP, KR_NCIS, NZ_CCID | 4 | CC(C)CCCCCCc1ccc(O)cc1 | https://cactus.nci.nih.gov/chemical/structure/84852-15-3/smiles | CACTUS | CC(C)CCCCCCc1ccc(O)cc1 | Train |
EU_REACH:
2-[[4-(diethylamino)-2-methylphenyl]azo]-5-nitrobenzene-1,3-dicarbonitrile | null | 84870-65-5 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/21423/7/4/2/?documentUUID=7b9f3905-5769-472a-a721-8af49966f5c7 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])C#N)C | https://pubchem.ncbi.nlm.nih.gov/compound/3020191 | PubChem | CCN(CC)c1ccc(N=Nc2c(C#N)cc([N+](=O)[O-])cc2C#N)c(C)c1 | Train |
EU_REACH:
1,3,5-triisopropyl-2,4-dinitrobenzene | null | 85187-23-1 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/11287/7/4/2/?documentUUID=1081bbfe-0c96-407d-ad47-644496acea1a | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC(C)C1=CC(=C(C(=C1[N+](=O)[O-])C(C)C)[N+](=O)[O-])C(C)C | https://pubchem.ncbi.nlm.nih.gov/compound/3020492 | PubChem | CC(C)c1cc(C(C)C)c([N+](=O)[O-])c(C(C)C)c1[N+](=O)[O-] | Train |
KR_NCIS:
Bis(1,1-dimethylethyl)[[(trifluoromethyl)sulfonyl]oxy]silyl 1,1,1-trifluoromethanesulfonate | null | 85272-31-7 | 1 | KR_NCIS: https://ncis.nier.go.kr/en/main.do, button "Hazardous chemical substances" | null | null | KR_NCIS | 1 | CC(C)(C)[Si](C(C)(C)C)(OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F | https://pubchem.ncbi.nlm.nih.gov/compound/545813 | PubChem | CC(C)(C)[Si](OS(=O)(=O)C(F)(F)F)(OS(=O)(=O)C(F)(F)F)C(C)(C)C | Train |
EU_REACH:
4-(1-phenylethyl)benzene-1,3-diol | null | 85-27-8 | 1 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/11024/7/4/2/?documentUUID=f28b4620-fd19-4c60-9dde-cf8b9452769d | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC(C1=CC=CC=C1)C2=C(C=C(C=C2)O)O | https://pubchem.ncbi.nlm.nih.gov/compound/11171903 | PubChem | CC(c1ccccc1)c1ccc(O)cc1O | Train |
EU_REACH:
2,3,3a,4,7,7a-hexahydro-1H-isoindole-1,3-dione | null | 85-40-5 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/1194/7/4/2/?documentUUID=e6a19792-1bd7-488f-a03a-87d77bf19551 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C1C=CCC2C1C(=O)NC2=O | https://pubchem.ncbi.nlm.nih.gov/compound/6808 | PubChem | O=C1NC(=O)C2CC=CCC12 | Train |
NZ_CCID:
1-Naphthalenesulphonyl chloride | null | 85-46-1 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/9A2D4A0C-FC49-45E0-A72F-4F0E34F49525 | NZ_CCID:
Skin Irritation
R PHRASE: R 34 [CHEMWATCH]
Eye Irritation
R PHRASE: R 41 [CHEMWATCH] | null | NZ_CCID | 1 | C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)Cl | https://pubchem.ncbi.nlm.nih.gov/compound/66560 | PubChem | O=S(=O)(Cl)c1cccc2ccccc12 | Train |
EU_REACH:
5-hept-6-enyloxolan-2-one | null | 854737-08-9 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/33826/7/4/2/?documentUUID=fcfe1616-315b-42d9-9865-064e2e03da5d | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C=CCCCCCC1CCC(=O)O1 | https://pubchem.ncbi.nlm.nih.gov/compound/86055585 | PubChem | C=CCCCCCC1CCC(=O)O1 | Train |
JP_CHRIP:
Chlorinated paraffin (C=14-17) | null | 85535-85-9 | 0 | JP_CHRIP: https://www.nite.go.jp/chem/ghs/21-meti-0016.html | JP_CHRIP:
【分類根拠】
（１）、（２）より、区分に該当しない（国連分類基準の区分3）。
【根拠データ】
（１）本物質（塩素含有率：40％）について、ウサギ（n=6）を用いた皮膚刺激性試験（OECD TG 404、閉塞、4時間適用、14日観察）において、皮膚の乾燥・硬化と皮膚外層の剥離が72時間後及び6～8日後に、痂皮鱗片化が6～10日後にみられた（適用24/48/72h後の紅斑・痂皮スコアの平均：1.5、浮腫スコアの平均：0.6）との報告がある（AICIS IMAP (2015)、REACH登録情報 (Accessed May 2021)）。
（２）本物質（塩素含有率：52％）について、ウサギ（n=6）を用いた皮膚刺激性... | Provided | JP_CHRIP | 1 | CC(CC(CC(CCCC(CC(CC(C)Cl)Cl)Cl)Cl)Cl)Cl | https://pubchem.ncbi.nlm.nih.gov/compound/121232961 | PubChem | CC(Cl)CC(Cl)CC(Cl)CCCC(Cl)CC(Cl)CC(C)Cl | Train |
KR_NCIS:
N-Methyl-2,4-cyclopentadiene-1-ethanamine | null | 857023-53-1 | 1 | KR_NCIS: https://ncis.nier.go.kr/en/main.do, button "Hazardous chemical substances" | null | null | KR_NCIS | 1 | CNCCC1C=CC=C1 | https://pubchem.ncbi.nlm.nih.gov/compound/12109886 | PubChem | CNCCC1C=CC=C1 | Train |
EU_REACH:
2-(trifluoromethyl)benzenesulfonyl isocyanate | null | 85813-73-6 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/10851/7/4/2/?documentUUID=bf564dfc-00f2-4653-9afc-7849a031035a | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C1=CC=C(C(=C1)C(F)(F)F)S(=O)(=O)N=C=O | https://pubchem.ncbi.nlm.nih.gov/compound/11817579 | PubChem | O=C=NS(=O)(=O)c1ccccc1C(F)(F)F | Train |
KR_NCIS:
Tridecylamine, branched and linear | null | 86089-17-0 | 1 | KR_NCIS: https://ncis.nier.go.kr/en/main.do, button "Hazardous chemical substances" | null | null | KR_NCIS | 1 | CCCC(CC)CCCCCCCN | https://pubchem.ncbi.nlm.nih.gov/compound/22833454 | PubChem | CCCC(CC)CCCCCCCN | Train |
EU_REACH:
2-(2-oxoimidazolidin-1-yl)ethyl methacrylate | null | 86261-90-7 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/13683/7/4/2/?documentUUID=c01bffd2-ac73-4827-9ed0-e2cc72062696 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC(=C)C(=O)OCCN1CCNC1=O | https://pubchem.ncbi.nlm.nih.gov/compound/643493 | PubChem | C=C(C)C(=O)OCCN1CCNC1=O | Train |
EU_REACH:
9-ethyl-9H-carbazole | null | 86-28-2 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/5801/7/4/2/?documentUUID=1685823b-dd0c-476c-8ff1-a9ba327832c5 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CCN1C2=CC=CC=C2C3=CC=CC=C31 | https://pubchem.ncbi.nlm.nih.gov/compound/6836 | PubChem | CCn1c2ccccc2c2ccccc21 | Train |
NZ_CCID:
1-(Chloromethyl) naphthalene | null | 86-52-2 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/607893E1-BDAE-4203-AD22-853C31CE5B76 | NZ_CCID:
Skin Irritation
R PHRASE: R 34 [Company Data]
Eye Irritation
R PHRASE: R 34 [Company Data] | null | NZ_CCID | 1 | C1=CC=C2C(=C1)C=CC=C2CCl | https://pubchem.ncbi.nlm.nih.gov/compound/6845 | PubChem | ClCc1cccc2ccccc12 | Train |
EU_REACH:
617-879-7 | null | 865536-03-4 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/21282/7/4/2/?documentUUID=44846f64-ce62-495e-bfbb-3fcf9936bf78 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC1=C(C=CC=C1NC(=O)OCCCCCCCCCCC(C)C)NC(=O)NCC2=CC(=CC=C2)CNC(=O)NC3=C(C(=CC=C3)NC(=O)OCCCCCCCCCCC(C)C)C | https://pubchem.ncbi.nlm.nih.gov/compound/154734779 | PubChem | Cc1c(NC(=O)NCc2cccc(CNC(=O)Nc3cccc(NC(=O)OCCCCCCCCCCC(C)C)c3C)c2)cccc1NC(=O)OCCCCCCCCCCC(C)C | Train |
EU_REACH:
(3AS,4S,6AR)-4-METHOXYTETRAHYDROFURO[3,4- B]FURAN-2(3H)-ONE | null | 866594-60-7 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/25324/7/4/2/?documentUUID=97f48c94-4a3a-431e-aced-f6ffeca508c4 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CO[C@@H]1[C@H]2CC(=O)O[C@H]2CO1 | https://pubchem.ncbi.nlm.nih.gov/compound/11600708 | PubChem | CO[C@H]1OC[C@@H]2OC(=O)C[C@H]12 | Train |
EU_REACH:
[(2R,3R,4R,5S,6S)-3,4,5-tris(acetyloxy)-6-(3-{[5-(4-fluorophenyl)thiophen-2-yl]methyl}-4-methylphenyl)oxan-2-yl]methyl acetate | null | 866607-35-4 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/30373/7/4/2/?documentUUID=ad783eea-1de3-4f27-b407-aa326147fcc5 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC1=C(C=C(C=C1)[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)CC3=CC=C(S3)C4=CC=C(C=C4)F | https://pubchem.ncbi.nlm.nih.gov/compound/25224976 | PubChem | CC(=O)OC[C@H]1O[C@@H](c2ccc(C)c(Cc3ccc(-c4ccc(F)cc4)s3)c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O | Train |
EU_REACH:
Benzoic acid, 4-[ (1-oxodecyl) oxy]- | null | 86960-46-5 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/5452/7/4/2/?documentUUID=ae5e57d1-142b-41de-ab6a-9a19ba0e2a8c | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CCCCCCCCCC(=O)OC1=CC=C(C=C1)C(=O)O | https://pubchem.ncbi.nlm.nih.gov/compound/3608562 | PubChem | CCCCCCCCCC(=O)Oc1ccc(C(=O)O)cc1 | Train |
EU_REACH:
3,3,10,10-tetramethoxy-2,11-dioxa-3,10-disiladodecane | null | 87135-01-1 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/1492/7/4/2/?documentUUID=cfdfc51e-e9fa-425f-a99b-bb66468020d2 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CO[Si](CCCCCC[Si](OC)(OC)OC)(OC)OC | https://pubchem.ncbi.nlm.nih.gov/compound/159046 | PubChem | CO[Si](CCCCCC[Si](OC)(OC)OC)(OC)OC | Train |
EU_REACH:
octadecanedioic acid | null | 871-70-5 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/5505/7/4/2/?documentUUID=c24ff0c1-e46d-468a-b3fe-2ff1df3c125d | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C(CCCCCCCCC(=O)O)CCCCCCCC(=O)O | https://pubchem.ncbi.nlm.nih.gov/compound/70095 | PubChem | O=C(O)CCCCCCCCCCCCCCCCC(=O)O | Train |
EU_REACH:
Bis(2-ethylhexyl) 2-(4-hydroxy-3,5-dimethoxybenzyl)propanedioate | null | 872182-46-2 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/4368/7/4/2/?documentUUID=684cac9b-1d6b-4687-ba4e-398a9d852532 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CCCCC(CC)COC(=O)C(CC1=CC(=C(C(=C1)OC)O)OC)C(=O)OCC(CC)CCCC | https://pubchem.ncbi.nlm.nih.gov/compound/11961068 | PubChem | CCCCC(CC)COC(=O)C(Cc1cc(OC)c(O)c(OC)c1)C(=O)OCC(CC)CCCC | Train |
EU_REACH:
ethyl {[4-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)phenyl]amino}acetate | null | 872728-83-1 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/16526/7/4/2/?documentUUID=291fcd61-3684-449b-b335-4b4b7a36c007 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CCOC(=O)CNC1=CC=C(C=C1)C2=NOC(=O)N2 | https://pubchem.ncbi.nlm.nih.gov/compound/135741406 | PubChem | CCOC(=O)CNc1ccc(-c2noc(=O)[nH]2)cc1 | Train |
EU_REACH:
(4Z)-hept-4-en-2-yl salicylate | null | 873888-84-7 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/1703/7/4/2/?documentUUID=b81c72b0-8edc-4600-92be-3c0cdb9264a0 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC/C=C\CC(C)OC(=O)C1=CC=CC=C1O | https://pubchem.ncbi.nlm.nih.gov/compound/67480918 | PubChem | CC/C=C\CC(C)OC(=O)c1ccccc1O | Train |
EU_REACH:
N-{2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbonyl]-6-fluorophenyl}-1,1-difluoro-N-methylmethanesulfonamide | null | 874195-61-6 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/6582/7/4/2/?documentUUID=442ff565-b688-403e-a0b3-1ddce977f863 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CN(C1=C(C=CC=C1F)C(=O)C2=NC(=NC(=N2)OC)OC)S(=O)(=O)C(F)F | https://pubchem.ncbi.nlm.nih.gov/compound/16004663 | PubChem | COc1nc(OC)nc(C(=O)c2cccc(F)c2N(C)S(=O)(=O)C(F)F)n1 | Train |
NZ_CCID:
4-Toluoyl chloride | NZ_CCID:
p-toluoyl chloride | 874-60-2 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/826D83EC-F9CE-45C8-A978-BC125BE485DF | NZ_CCID:
Skin Irritation
R PHRASE: R 34 [Company Data]
Eye Irritation
R PHRASE: R 34 [Company Data] | null | NZ_CCID | 1 | CC1=CC=C(C=C1)C(=O)Cl | https://pubchem.ncbi.nlm.nih.gov/compound/13405 | PubChem | Cc1ccc(C(=O)Cl)cc1 | Train |
JP_CHRIP:
Mucochloric acid
NZ_CCID:
Dichloromalealdehydic acid | JP_CHRIP:
Mucochloric acid
NZ_CCID:
mucochloric acid | 87-56-9 | 1 | JP_CHRIP: https://www.nite.go.jp/chem/english/ghs/12-mhlw-0034e.html
NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/83AF56F1-F1C8-451B-9766-5B4DFF295F77 | JP_CHRIP:
In a test by a 4-hour occlusive application of 0.5 g of an 80% aqueous solution of this substance to the skin of two rabbits (Test guidelines of the US Department of Transportation), the average scores after 4 hours, 1 day, 2 days, and 8 days were 3.5, 4, 4, 4, respectively for erythema, and 3, 3, 3, 1.5 for ... | null | JP_CHRIP, NZ_CCID | 2 | OC(=O)/C(=C(/Cl)\C=O)/Cl | https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.902K | J-GLOBAL | O=C/C(Cl)=C(/Cl)C(=O)O | Train |
EU_REACH:
(2R,3R)-2,3-dihydroxybutanedioic acid | null | 87-69-4 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/15126/7/4/2/?documentUUID=b4aed523-b21d-4080-a48f-d6e88c261d06 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | [C@@H]([C@H](C(=O)O)O)(C(=O)O)O | https://pubchem.ncbi.nlm.nih.gov/compound/444305 | PubChem | O=C(O)[C@H](O)[C@@H](O)C(=O)O | Train |
EU_REACH:
N-{3',4'-dichloro-5-fluoro-[1,1'-biphenyl]-2-yl}acetamide | null | 877179-03-8 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/29709/7/4/2/?documentUUID=ba837944-2e4e-4950-aa24-41318a3388ae | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC(=O)NC1=C(C=C(C=C1)F)C2=CC(=C(C=C2)Cl)Cl | https://pubchem.ncbi.nlm.nih.gov/compound/44139270 | PubChem | CC(=O)Nc1ccc(F)cc1-c1ccc(Cl)c(Cl)c1 | Train |
EU_REACH:
3',4'-dichloro-5-fluorobiphenyl-2-amine | null | 877179-04-9 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/8025/7/4/2/?documentUUID=64a20569-b236-4fd4-bd83-b681b09b7437 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C1=CC(=C(C=C1C2=C(C=CC(=C2)F)N)Cl)Cl | https://pubchem.ncbi.nlm.nih.gov/compound/11572419 | PubChem | Nc1ccc(F)cc1-c1ccc(Cl)c(Cl)c1 | Train |
EU_REACH:
(1S)-1-(2,6-dichloro-3-fluorophenyl)ethan-1-ol | null | 877397-65-4 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/10776/7/4/2/?documentUUID=fcabcf14-fd44-4b7b-93e0-313b46212807 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C[C@@H](C1=C(C=CC(=C1Cl)F)Cl)O | https://pubchem.ncbi.nlm.nih.gov/compound/11557536 | PubChem | C[C@H](O)c1c(Cl)ccc(F)c1Cl | Train |
EU_REACH:
5-bromo-3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridin-2-amine | null | 877399-00-3 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/11079/7/4/2/?documentUUID=4983e025-4007-4692-a10b-66797ac54227 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C[C@H](C1=C(C=CC(=C1Cl)F)Cl)OC2=C(N=CC(=C2)Br)N | https://pubchem.ncbi.nlm.nih.gov/compound/11689426 | PubChem | C[C@@H](Oc1cc(Br)cnc1N)c1c(Cl)ccc(F)c1Cl | Train |
EU_REACH:
(1R)-1-[(4R,4aR,8aS)-2,6-bis(4-methylphenyl)-hexahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl]ethane-1,2-diol | null | 87826-41-3 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/6843/7/4/2/?documentUUID=e5752db4-0593-43fc-bed7-b6f88bf9714c | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | C/C(=C(/O)\[C@H](O)[C@@H](O)[C@H](O)[C@H](O)/C(=C(/C1=CC=CC=C1)\C)/O)/C2=CC=CC=C2 | https://pubchem.ncbi.nlm.nih.gov/compound/90474944 | PubChem | C/C(=C(/O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C(O)=C(\C)c1ccccc1)c1ccccc1 | Train |
EU_REACH:
N-[ethenyl(N-ethylacetamido)methylsilyl]-N-ethylacetamide | null | 87855-59-2 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/7533/7/4/2/?documentUUID=9d6a6151-c7cb-4b18-972b-bba8707f140b | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CCN(C(=O)C)[Si](C)(C=C)N(CC)C(=O)C | https://pubchem.ncbi.nlm.nih.gov/compound/14440330 | PubChem | C=C[Si](C)(N(CC)C(C)=O)N(CC)C(C)=O | Train |
EU_REACH:
3-(dodecylsulfanyl)-1-[(1S,2R)-2,6,6-trimethylcyclohex-3-en-1-yl]butan-1-one | null | 878665-13-5 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/16259/7/4/2/?documentUUID=f1db150b-c66e-4082-927b-024e1d791f32 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CCCCCCCCCCCCSC(C)CC(=O)[C@@H]1[C@H](C=CCC1(C)C)C | https://pubchem.ncbi.nlm.nih.gov/compound/101391704 | PubChem | CCCCCCCCCCCCSC(C)CC(=O)[C@@H]1[C@@H](C)C=CCC1(C)C | Train |
NZ_CCID:
1-Naphthalenecarbonyl chloride | null | 879-18-5 | 1 | NZ_CCID: https://www.epa.govt.nz/database-search/chemical-classification-and-information-database-ccid/view/66561D91-1E74-4479-A271-0A3EE95FB03A | NZ_CCID:
Skin Irritation
R PHRASE: R 34 [CHEMWATCH]
Eye Irritation
R PHRASE: R 41 [CHEMWATCH] | null | NZ_CCID | 1 | C1=CC=C2C(=C1)C=CC=C2C(=O)Cl | https://pubchem.ncbi.nlm.nih.gov/compound/70146 | PubChem | O=C(Cl)c1cccc2ccccc12 | Train |
EU_REACH:
2-ethoxy-N-hydroxybenzenecarboximidamide | null | 879-57-2 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/20892/7/4/2/?documentUUID=dcdb399d-b9e9-49df-811b-1ac38197fba8 | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CCOC1=CC=CC=C1/C(=N/O)/N | https://pubchem.ncbi.nlm.nih.gov/compound/12052279 | PubChem | CCOc1ccccc1/C(N)=N/O | Train |
EU_REACH:
632-619-2 | null | 881685-58-1 | 0 | EU_REACH: https://echa.europa.eu/registration-dossier/-/registered-dossier/33201/7/4/2/?documentUUID=5521856f-cc44-4006-8983-8344e04bca4d | EU_REACH:
Experimental study (OECD TG 404, GLP) | Provided | EU_REACH | 1 | CC(C)C1C2CCC1C3=C2C=CC=C3NC(=O)C4=CN(N=C4C(F)F)C | https://pubchem.ncbi.nlm.nih.gov/compound/25271089 | PubChem | CC(C)C1C2CCC1c1c(NC(=O)c3cn(C)nc3C(F)F)cccc12 | Train |
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