92985-74-5

• 常用中文名：7-ethyl-1,3-dimethyl-6-sulfanylidenepurin-2-one
• 常用英文名：7-ethyl-1,3-dimethyl-6-sulfanylidenepurin-2-one
• CAS号：92985-74-5
• 分子式：C₉H₁₂N₄OS
• 分子量：224.28300
• 发布时间：2016-09-16 18:38:00
• 更新时间：2025-09-21 17:12:35

名称

• 英文名: 7-ethyl-1,3-dimethyl-6-sulfanylidenepurin-2-one
• 英文别名: M &M B 6631; 1,3-Dimethyl-7-aethyl-2-oxo-6-thioxo-1,2,3,6-tetrahydro-7H-purin; Theophylline,7-ethyl-6-thio; 7-Ethyl-6-thiotheophylline; 7-ethyl-1,3-dimethyl-6-thioxo-1,3,6,7-tetrahydro-purin-2-one; B 6631

物化性质

• 分子式: C₉H₁₂N₄OS
• 分子量: 224.28300
• 精确质量: 224.07300
• PSA: 76.84000
• LogP: 0.82290

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : XH5621000 CHEMICAL NAME : Theophylline, 7-ethyl-6-thio- CAS REGISTRY NUMBER : 92985-74-5 BEILSTEIN REFERENCE NO. : 0532656 LAST UPDATED : 199612 DATA ITEMS CITED : 1 MOLECULAR FORMULA : C9-H12-N4-O-S MOLECULAR WEIGHT : 224.31 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 515 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : BJPCAL British Journal of Pharmacology and Chemotherapy. (London, UK) V.1-33, 1946-68. For publisher information, see BJPCBM. Volume(issue)/page/year: 17,196,1961