Acetonitrile,((1-(p-fluorobenzyl)-2-methyl-4-nitro-1H-imidazol-5-yl)thio)-
CAS 77952-80-8 MFCD00605668
化学结构图
SMILES: CC1=NC(=C(SCC#N)N1CC1C=CC(F)=CC=1)[N+]([O-])=O
化学属性
| Mol. Formula | C13H11FN4O2S |
|---|---|
| Mol. Weight | 306.34 |
别名和识别编码
| Chemical Name | Acetonitrile,((1-(p-fluorobenzyl)-2-methyl-4-nitro-1H-imidazol-5-yl)thio)- |
|---|---|
| Wiswesser Line Notation | T5N CNJ A1R DF& B1 DNW ES1CN |
| Synonym | ((1-(p-Fluorobenzyl)-2-methyl-4-nitro-1H-imidazol-5-yl)thio)acetonitrile |
| Beilstein Registry Number | 5133809 |
| CAS Number | 77952-80-8 |
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安全信息
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 780 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: 15,97,1981
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