87587-17-5

• 常用中文名：1H-Azepine-1-carbothioic acid, hexahydro-, 2-(1-(2-pyridyl)ethyl)hydrazide, N-oxide
• 常用英文名：1H-Azepine-1-carbothioic acid, hexahydro-, 2-(1-(2-pyridyl)ethyl)hydrazide, N-oxide
• CAS号：87587-17-5
• 分子式：C₁₄H₂₂N₄OS
• 分子量：294.41600
• 发布时间：2017-05-05 15:21:01
• 更新时间：2024-01-16 19:07:01

名称

• 英文名: N'-[1-(1-oxidopyridin-1-ium-2-yl)ethyl]azepane-1-carbothiohydrazide
• 英文别名: Hexahydro-1H-azepine-1-carbothioic acid 2-(1-(2-pyridyl)ethyl)hydrazide N'''-oxide; 1H-Azepine-1-carbothioic acid,hexahydro-,2-(1-(2-pyridyl)ethyl)hydrazide,N'''-oxide

物化性质

• 密度: 1.24g/cm3
• 沸点: 489ºC at 760 mmHg
• 分子式: C₁₄H₂₂N₄OS
• 分子量: 294.41600
• 闪点: 249.5ºC
• 精确质量: 294.15100
• PSA: 84.85000
• LogP: 3.15090
• 折射率: 1.626

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : CM2626000 CHEMICAL NAME : 1H-Azepine-1-carbothioic acid, hexahydro-, 2-(1-(2-pyridyl)ethyl)hydrazide, N'''-oxide CAS REGISTRY NUMBER : 87587-17-5 LAST UPDATED : 199612 DATA ITEMS CITED : 1 MOLECULAR FORMULA : C14-H22-N4-O-S MOLECULAR WEIGHT : 294.46 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 320 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 27,87,1984

合成路线

111-49-9 87587-21-1 ~56% 87587-17-5

文献：Scovill, John P.; Klayman, Daniel L.; Lambros, Chris; Childs, George E.; Notsch, John D. Journal of Medicinal Chemistry, 1984 , vol. 27, # 1 p. 87 - 91

2457-50-3 ~% 87587-17-5

文献：Scovill, John P.; Klayman, Daniel L.; Lambros, Chris; Childs, George E.; Notsch, John D. Journal of Medicinal Chemistry, 1984 , vol. 27, # 1 p. 87 - 91

87587-00-6 ~% 87587-17-5

文献：Scovill, John P.; Klayman, Daniel L.; Lambros, Chris; Childs, George E.; Notsch, John D. Journal of Medicinal Chemistry, 1984 , vol. 27, # 1 p. 87 - 91

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