CAS Chem.name SMILES #CA_without_S9 #Obs_CA_with_S9 Bioassay - Reference(s) - 76-44-8 Heptachlor ClC1C=CC2C1C1(Cl)C(Cl)=C(Cl)C2(Cl)C1(Cl)Cl negative positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 85-01-8 Phenanthrene c1ccc2c(c1)ccc1ccccc12 negative negative in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 87-61-6 "1,2,3-Trichlorobenzene" Clc1cccc(Cl)c1Cl negative negative in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 98-83-9 alpha-Methylstyrene CC(=C)c1ccccc1 negative negative in Vitro Mammalian Chromosome Aberration Test NIHS Japan 110-02-1 Thiophene c1ccsc1 negative negative in Vitro Mammalian Chromosome Aberration Test NIHS Japan 226-36-8 "Dibenz(a,h)acridine" c1ccc2c(c1)ccc1nc3c(ccc4ccccc43)cc12 negative positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 91-22-5 quinoline c1ccc2ncccc2c1 negative positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 92-52-4 Biphenyl c1ccc(cc1)-c1ccccc1 negative positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 94-59-7 Safrole C=CCc1ccc2OCOc2c1 negative positive in Vitro Mammalian Chromosome Aberration Test "Ishidate Jr., M., and T. Sofuni (1985) in: J. Ashby et al.(Eds.), Progress in Mutation Research, Vol. 5, Elsevier," 95-50-1 "1,2-Dichlorobenzene" Clc1ccccc1Cl negative positive in Vitro Mammalian Chromosome Aberration Test NIHS Japan 100-42-5 Styrene C=Cc1ccccc1 negative positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 120-12-7 Anthracene c1ccc2cc3ccccc3cc2c1 negative positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 129-00-0 Pyrene c1cc2ccc3cccc4ccc(c1)c2c34 negative positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 224-42-0 "Dibenz(a,j)acridine" c1ccc2c(c1)ccc1nc3ccc4ccccc4c3cc12 negative positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 224-53-3 "Dibenz(c,h)acridine" c1ccc2c(c1)ccc1cc3ccc4ccccc4c3nc12 negative positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 584-79-2 Allethrin CC(C)=CC1C(C(=O)OC2CC(=O)C(CC=C)=C2C)C1(C)C negative positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 956-90-1 Phencyclidine_hydrochloride C1CCN(CC1)C1(CCCCC1)c1ccccc1 negative positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 2216-69-5 1-Methoxynaphthalene COc1cccc2ccccc12 negative positive in Vitro Mammalian Chromosome Aberration Test NIHS Japan 106-37-6 p-Dibromobenzene Brc1ccc(Br)cc1 negative positive in Vitro Mammalian Chromosome Aberration Test NIHS Japan 2778-42-9 "1,3-Bis(1-isocyanato-1-methylethyl)benzene" CC(C)(N=C=O)c1cccc(c1)C(C)(C)N=C=O negative negative in Vitro Mammalian Chromosome Aberration Test http://apps.echa.europa.eu/registered/data/dossiers/DISS-9ea4f857-0e7e-4de5-e044-00144f67d031/AGGR-bf6ee7e9-b870-4fd0-9657-265242b6de8f_DISS-9ea4f857-0e7e-4de5-e044-00144f67d031.html#GEN_DATA_SOURCE_HD 91-64-5 2h-1-benzopyran-2-one O=C1Oc2ccccc2C=C1 negative positive in Vitro Mammalian Chromosome Aberration Test "Galloway, Sm., Armstrong, Mj., Reuben, C., Colman, S., Brown, B., Cannon, C., Bloom, A.D., Nakamura, F., Ahmed, M., Duk, S., Rimpo, J., Margolin, Bh., Resnick, Ma., Anderson, B. and Zeiger, E.; Chromosome Aberrations and Sister Chromatid Exchanges in Chinese Hamster Ovary Cells: Evaluations Of 108 Chemicals; Environ. Mol. Mutagen. 10(Suppl. 10):1-175, 1987" 394-69-4 5-fluoroquinoline Fc1cccc2ncccc12 negative positive in Vitro Mammalian Chromosome Aberration Test "Suzuki, T., Takeshita, K., Saeki, K., Kadoi, M., Hayashi, M. and Sofuni, T.; Clastogenicity of Quinoline and Monofluorinated Quinolines in Chinese Hamster Lung Cells; J. Health Sci. 53(3):325-328, 2007" 91-20-3 Naphthalene c1ccc2ccccc2c1 negative positive in Vitro Mammalian Chromosome Aberration Test "JAPAN CHEMICAL INDUSTRY ECOLOGY-TOXICOLOGY & INFORMATION CENTER (JETOC), JAPAN; MUTAGENICITY TEST DATA OF EXISTING CHEMICAL SUBSTANCES BASED ON THE TOXICITY INVESTIGATION SYSTEM OF THE INDUSTRIAL SAFETY AND HEALTH LAW, SUPPLEMENT 4; 2008" 54-31-9 Furosemide NS(=O)(=O)c1cc(C(O)=O)c(NCc2ccco2)cc1Cl positive positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 79-06-1 2-propenamide;_Acrylamide NC(=O)C=C positive positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 96-09-3 Styrene Oxide C1OC1c1ccccc1 positive positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 96-13-9 "2,3-Dibromo-1-Propanol" OCC(Br)CBr positive positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 106-89-8 (chloromethyl)oxirane ClCC1CO1 positive positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 109-64-8 "1,3-Dibromopropane" BrCCCBr positive positive in Vitro Mammalian Chromosome Aberration Test NIHS Japan 109-70-6 "1-bromo-3-chloropropane;_Propane,_1-bromo-3-chloro-" ClCCCBr positive positive in Vitro Mammalian Chromosome Aberration Test NIHS Japan 122-60-1 Phenyl glycidyl ether C1OC1COc1ccccc1 positive positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 189-92-4 Pyrenoline c1cnc2c(c1)cc1ccc3cccc4ccc2c1c34 positive positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 230-27-3 alpha-Naphthoquinoline c1ccc2c(c1)ccc1cccnc12 positive positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 542-75-6 "1,3-Dichloropropene" ClCC=CCl positive positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 1024-57-3 heptachlor_epoxide ClC1C2OC2C2C1C1(Cl)C(Cl)=C(Cl)C2(Cl)C1(Cl)Cl positive positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 2451-62-9 "Tris_(2,3-epoxypropyl)_isocyanurate" O=C1N(CC2CO2)C(=O)N(CC2CO2)C(=O)N1CC1CO1 positive positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 42397-64-8 "1,6-Dinitropyrene" [O-][N+](=O)c1ccc2ccc3c(ccc4ccc1c2c43)[N+]([O-])=O positive positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 42397-65-9 "1,8-Dinitropyrene" [O-][N+](=O)c1ccc2ccc3ccc(c4ccc1c2c34)[N+]([O-])=O positive positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 67977-01-9 "Pyrenoline_4,5-oxide" O1C2C1c1cc3cccnc3c3ccc4cccc2c4c13 positive positive in Vitro Mammalian Chromosome Aberration Test "Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan" 91-76-9 "1,3,5-triazine-2,4-diamine,_6-phenyl-" Nc1nc(N)nc(n1)-c1ccccc1 positive positive in Vitro Mammalian Chromosome Aberration Test NIHS Japan 7532-20-9 "1,3-Dinitropyrene" [O-][N+](=O)c1cc(c2ccc3cccc4ccc1c2c43)[N+]([O-])=O positive positive in Vitro Mammalian Chromosome Aberration Test "Danish EPA Inventory, Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test In Vitro, Revised Edition. Life-Science Information Center; Tokyo, Japan." 78-87-5 "1,2-Dichloropropane" CC(Cl)CCl positive positive in Vitro Mammalian Chromosome Aberration Test "Galloway S., et al., Environ .Mol. Mutagen., 10, 1-75, 1987." 85-02-9 "Benzo(f)quinoline; 5,6-Benzoquinoline" c1ccc2c(c1)ccc1ncccc12 positive positive in Vitro Mammalian Chromosome Aberration Test "Matsuoka A., Shudo K., Saito Y., Sofuni T., Ishidate M Jr., Clastogenic potential of heavy oil extracts and some aza-arenes in Chinese hamster cells in culture. Mutat. Res., 1982 Oct-Nov; 102(3):257-283" 106-93-4 "1,2-Dibromoethane" BrCCBr positive positive in Vitro Mammalian Chromosome Aberration Test "H. Tezuka, N. Ando, R. Suzuki, M. Terahata, M. Moriya, Y. Shirasu, Sister-chromatid exchanges and chromosomal aberrations in cultured Chinese hamster cells treated with pesticides positive in microbial reversion assays. Mutat. Res., 1980, 78(2),177-191." 75-56-9 propylene oxide CC1CO1 positive positive in Vitro Mammalian Chromosome Aberration Test "JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION CENTER, JAPAN; MUTAGENICITY TEST DATA OF EXISTING CHEMICAL SUBSTANCES BASED ON THE TOXICITY INVESTIGATION OF THE INDUSTRIAL SAFETY AND HEALTH LAW; 1996" 106-92-3 Allyl glycidyl ether C=CCOCC1CO1 positive positive in Vitro Mammalian Chromosome Aberration Test "JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION CENTER, JAPAN; MUTAGENICITY TEST DATA OF EXISTING CHEMICAL SUBSTANCES BASED ON THE TOXICITY INVESTIGATION OF THE INDUSTRIAL SAFETY AND HEALTH LAW; 1996" 101-90-6 Diglycidyl resorcinol ether C1OC1COc1cccc(OCC2CO2)c1 positive positive in Vitro Mammalian Chromosome Aberration Test "GULATI,DK, WITT,K, ANDERSON,B, ZEIGER,E AND SHELBY,MD; CHROMOSOME ABERRATION AND SISTER CHROMATID EXCHANGE TESTS IN CHINESE HAMSTER OVARY CELLS IN VITRO. III: RESULTS WITH 27 CHEMICALS; ENVIRON. MOL. MUTAGEN. 13(2):133-193, 1989" 106-88-7 1-Butene oxide CCC1CO1 positive positive in Vitro Mammalian Chromosome Aberration Test "NTP report on the Toxicology and Carcinogenesis studies of 1,2-etoxybutane (CAS 106-88-7) in F344/N rats and B6C3F1 mice, March 1988, NTP TR 329" 5694-00-8 glycidamide; oxirane-2-carboxamide NC(=O)C1CO1 positive positive in Vitro Mammalian Chromosome Aberration Test "MARTINS,C OLIVEIRA,N NUNO,G PINGARILHO,M GAMBOA DA COSTA,G MARTINS,V MARQUES,M BELAND,F CHURCHWELL,M DOEGRE,D RUEFF,J AND GASPAR,J; CYTOGENETIC DAMAGE INDUCED BY ACRYLAMIDE AND GLYCIDIAMIDE IN MAMMALIAN CELLS: CORRELATION WITH SPECIFIC GLYCIDAMIDE-DNA ADDUCTS; TOXICOLOGICAL SCIENCES 95(2):383-390, 2007" 100-63-0 phenylhydrazine NNc1ccccc1 positive positive in Vitro Mammalian Chromosome Aberration Test "JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION CENTER, JAPAN; MUTAGENICITY TEST DATA OF EXISTING CHEMICAL SUBSTANCES BASED ON THE TOXICITY INVESTIGATION OF THE INDUSTRIAL SAFETY AND HEALTH LAW; (SUPPL. 2), 2000" 107-02-8 Acrolein C=CC=O positive positive in Vitro Mammalian Chromosome Aberration Test "Ishidate, M., M. C. Harnois, T. Sofuni, A Comparative Analysis of Data on the Clastogenicity of 951 Chemical Substances Tested in Mammalian Cell Cultures, Mutat. Res. 195 (1988), 151 – 213" 106-91-2 Glycidyl methacrylate CC(=C)C(=O)OCC1CO1 positive positive in Vitro Mammalian Chromosome Aberration Test NIHS Japan 3688-53-7 2-(2-furyl)-3-(5-nitro-2-furyl)acrylamide; Furylfuramide NC(=O)C(=Cc1ccc(o1)[N+]([O-])=O)c1ccco1 positive positive in Vitro Mammalian Chromosome Aberration Test "U.S.Environmental Protection Agency Gene-Tox Program. Mutation Research, 168, (1996) pp. 69-240"