991-30-0

• 常用中文名：Benzoic acid, 3,4,5-trimethoxy-, 1-methyl-2-[4- (3,4, 5-trimethoxybenzoyl)-1-piperazinyl]ethyl ester, monohydrochloride
• 常用英文名：Benzoic acid, 3,4,5-trimethoxy-, 1-methyl-2-[4- (3,4, 5-trimethoxybenzoyl)-1-piperazinyl]ethyl ester, monohydrochloride
• CAS号：991-30-0
• 分子式：C₂₇H₃₇ClN₂O₉
• 分子量：569.04400
• 发布时间：2016-10-14 12:17:06
• 更新时间：2024-04-12 18:42:18

名称

• 英文名: Benzoic acid, 3,4,5-trimethoxy-, [1-[4-(3,4,5-trimethoxybenzoyl)piperazinylmethyl]ethyl] ester, hydrochloride

物化性质

• 密度: 1.193g/cm3
• 沸点: 645.2ºC at 760 mmHg
• 分子式: C₂₇H₃₇ClN₂O₉
• 分子量: 569.04400
• 闪点: 344ºC
• 精确质量: 568.21900
• PSA: 105.23000
• LogP: 3.41930
• 折射率: 1.542

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : DI0879500 CHEMICAL NAME : Benzoic acid, 3,4,5-trimethoxy-, 1-(4-(3,4,5-trimethoxybenzoyl)piperazzinylmethyl)ethy l ester,hydrochloride CAS REGISTRY NUMBER : 991-30-0 LAST UPDATED : 199012 DATA ITEMS CITED : 6 MOLECULAR FORMULA : C27-H36-N2-O9.Cl-H MOLECULAR WEIGHT : 569.11 WISWESSER LINE NOTATION : T6N DNTJ AVR CO1 DO1 EO1& D1Y1&OVR CO1 DO1 EO1 &GH HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 1500 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : 27ZQAG "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972 Volume(issue)/page/year: -,307,1972 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 160 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : 27ZQAG "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972 Volume(issue)/page/year: -,307,1972 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 1200 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : 27ZQAG "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972 Volume(issue)/page/year: -,307,1972 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 680 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : 27ZQAG "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972 Volume(issue)/page/year: -,307,1972 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 240 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : 27ZQAG "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972 Volume(issue)/page/year: -,307,1972 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - rabbit DOSE/DURATION : 200 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : 27ZQAG "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972 Volume(issue)/page/year: -,307,1972