[(3R,5S,8R,9S,10S,13S,14S)-10,13-二甲基-17-氧代-1,2,3,4,5,6,7,8,9,11,12,14,15,16-十四氢环戊烯并[a]菲-3-基]乙酸酯
[CAS# 1164-95-0]

基本信息

• 产品名称: [(3R,5S,8R,9S,10S,13S,14S)-10,13-二甲基-17-氧代-1,2,3,4,5,6,7,8,9,11,12,14,15,16-十四氢环戊烯并[a]菲-3-基]乙酸酯
• 英文名: [(3R,5S,8R,9S,10S,13S,14S)-10,13-Dimethyl-17-Oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-Tetradecahydrocyclopenta[a]Phenanthren-3-Yl] Acetate
• 别名: Acetic Acid [(3R,5S,8R,9S,10S,13S,14S)-10,13-Dimethyl-17-Oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-Tetradecahydrocyclopenta[A]Phenanthren-3-Yl] Ester; Acetic Acid [(3R,5S,8R,9S,10S,13S,14S)-17-Keto-10,13-Dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-Tetradecahydrocyclopenta[A]Phenanthren-3-Yl] Ester; [(3R,5S,8R,9S,10S,13S,14S)-10,13-Dimethyl-17-Oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-Tetradecahydrocyclopenta[A]Phenanthren-3-Yl] Ethanoate
• 分子式: C₂₁H₃₂O₃
• 分子量: 332.48
• CAS 登录号: 1164-95-0
• EINECS 登录号: 214-612-2
• 分子行输入简码 SMILES: [C@H]13[C@@H]([C@@]2([C@@H](CC1)C[C@H](OC(=O)C)CC2)C)CC[C@]4([C@H]3CCC4=O)C
• 国际化学标识码 InChI: 1S/C21H32O3/c1-13(22)24-15-8-10-20(2)14(12-15)4-5-16-17-6-7-19(23)21(17,3)11-9-18(16)20/h14-18H,4-12H2,1-3H3/t14-,15+,16-,17-,18-,20-,21-/m0/s1
• 国际化学标识检索码 InChIKey: FDCINQSOYQUNKB-XVYLQWLCSA-N

物理化学性质

• 密度: 1.099g/cm³ （计算值）
• 沸点: 424.64°C at 760 mmHg （计算值）
• 闪点: 182.816°C （计算值）