110579-01-6

• 常用中文名：2-((1-Methyl-4-nitro-1H-imidazol-5-yl)thio)acetonitrile
• 常用英文名：2-((1-Methyl-4-nitro-1H-imidazol-5-yl)thio)acetonitrile
• CAS号：110579-01-6
• 分子式：C₆H₆N₄O₂S
• 分子量：198.20200
• 发布时间：2018-06-20 19:07:59
• 更新时间：2024-02-07 16:14:24

名称

• 英文名: 2-(3-methyl-5-nitroimidazol-4-yl)sulfanylacetonitrile
• 英文别名: Acetonitrile,((1-methyl-4-nitro-1H-imidazol-5-yl)thio); ((1-Methyl-4-nitro-1H-imidazol-5-yl)thio)acetonitrile; 2-((1-Methyl-4-nitro-1H-imidazol-5-yl)thio)acetonitrile; Acetonitrile,2-[(1-methyl-4-nitro-1H-imidazol-5-yl)thio]

物化性质

• 密度: 1.5g/cm3
• 沸点: 453.2ºC at 760mmHg
• 分子式: C₆H₆N₄O₂S
• 分子量: 198.20200
• 闪点: 227.9ºC
• 精确质量: 198.02100
• PSA: 112.73000
• LogP: 1.46718
• 蒸汽压: 2.11E-08mmHg at 25°C
• 折射率: 1.679

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : AM0930000 CHEMICAL NAME : Acetonitrile, ((1-methyl-4-nitro-1H-imidazol-5-yl)thio)- CAS REGISTRY NUMBER : 110579-01-6 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 : 60 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

安全

• 海关编码: 2933290090

合成路线

107-14-2 13750-88-4 ~73% 110579-01-6

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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海关

海关编码	2933290090
中文概述	2933290090. 其他结构含非稠合咪唑环的化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素	品名, 成分含量, 用途, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期
Summary	2933290090. other compounds containing an unfused imidazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%