110579-00-5

• 常用中文名：2-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanyl]acetonitrile
• 常用英文名：2-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanyl]acetonitrile
• CAS号：110579-00-5
• 分子式：C₆H₆N₄O₂S
• 分子量：198.20200
• 发布时间：2016-04-25 01:09:17
• 更新时间：2024-04-01 20:09:32

名称

• 英文名: 2-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanyl]acetonitrile
• 英文别名: 2-((2-Methyl-4-nitro-1H-imidazol-5-yl)thio)acetonitrile; Acetonitrile,((2-methyl-5-nitro-1H-imidazol-4-yl)thio); ((2-Methyl-5-nitro-1H-imidazol-4-yl)thio)acetonitrile

物化性质

• 密度: 1.5g/cm3
• 沸点: 506.9ºC at 760 mmHg
• 分子式: C₆H₆N₄O₂S
• 分子量: 198.20200
• 闪点: 260.3ºC
• 精确质量: 198.02100
• PSA: 123.59000
• LogP: 1.76518
• 蒸汽压: 2.14E-10mmHg at 25°C
• 折射率: 1.623

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : AM0932000 CHEMICAL NAME : Acetonitrile, ((2-methyl-5-nitro-1H-imidazol-4-yl)thio)- CAS REGISTRY NUMBER : 110579-00-5 LAST UPDATED : 199612 DATA ITEMS CITED : 1 MOLECULAR FORMULA : C6-H6-N4-O2-S MOLECULAR WEIGHT : 198.22 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 100 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 21,403,1987

合成路线

107-14-2 13750-86-2 ~61% 110579-00-5

文献：Iradyan, M. A.; Ayvazyan, A. Kh.; Mirzoyan, V. S.; Paronikyan, G. M.; Sarkisyan, T. P.; et al. Pharmaceutical Chemistry Journal, 1987 , vol. 21, # 6 p. 403 - 408 Khimiko-Farmatsevticheskii Zhurnal, 1987 , vol. 21, # 6 p. 667 - 672

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