74039-68-2

• 常用中文名：1H-Purine-2,6-dione, 8-(3-cyclohexen-1-yl)-3,7-dihydro-1,3-dimethyl- (9CI)
• 常用英文名：1H-Purine-2,6-dione, 8-(3-cyclohexen-1-yl)-3,7-dihydro-1,3-dimethyl- (9CI)
• CAS号：74039-68-2
• 分子式：C₁₃H₁₆N₄O₂
• 分子量：260.29200
• 发布时间：2017-11-15 14:24:55
• 更新时间：2023-01-16 07:38:20

名称

• 英文名: 8-cyclohex-3-en-1-yl-1,3-dimethyl-7H-purine-2,6-dione
• 英文别名: 8-(3-Cyclohexen-1-yl)theophylline; Theophylline,8-(3-cyclohexen-1-yl); 1H-Purine-2,6-dione,8-(3-cyclohexen-1-yl)-3,7-dihydro-1,3-dimethyl

物化性质

• 密度: 1.318g/cm3
• 沸点: 524ºC at 760 mmHg
• 分子式: C₁₃H₁₆N₄O₂
• 分子量: 260.29200
• 闪点: 270.7ºC
• 精确质量: 260.12700
• PSA: 72.68000
• LogP: 0.78400
• 折射率: 1.611

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : XH5093320 CHEMICAL NAME : Theophylline, 8-(3-cyclohexen-1-yl)- CAS REGISTRY NUMBER : 74039-68-2 LAST UPDATED : 197906 DATA ITEMS CITED : 1 MOLECULAR FORMULA : C13-H16-N4-O2 MOLECULAR WEIGHT : 260.33 WISWESSER LINE NOTATION : T56 BM DN FNVNVJ C- CL6UTJ& F1 H1 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 18 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#06896