[(5S,8S,9S,10S,13S,14S,17S)-10,13-二甲基-3-氧代-2-(2,2,2-三氟乙酰基)-1,2,4,5,6,7,8,9,11,12,14,15,16,17-十四氢环戊烯并[a]菲-17-基]乙酸酯
[CAS# 1880-36-0]

基本信息

• 产品名称: [(5S,8S,9S,10S,13S,14S,17S)-10,13-二甲基-3-氧代-2-(2,2,2-三氟乙酰基)-1,2,4,5,6,7,8,9,11,12,14,15,16,17-十四氢环戊烯并[a]菲-17-基]乙酸酯
• 英文名: [(5S,8S,9S,10S,13S,14S,17S)-10,13-Dimethyl-3-Oxo-2-(2,2,2-Trifluoroacetyl)-1,2,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydrocyclopenta[a]Phenanthren-17-Yl] Acetate
• 别名: Acetic Acid [(5S,8R,9S,10S,13S,14S,17S)-10,13-Dimethyl-3-Oxo-2-(2,2,2-Trifluoro-1-Oxoethyl)-1,2,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-17-Yl] Ester; Acetic Acid [(5S,8R,9S,10S,13S,14S,17S)-3-Keto-10,13-Dimethyl-2-(2,2,2-Trifluoroacetyl)-1,2,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-17-Yl] Ester; [(5S,8R,9S,10S,13S,14S,17S)-10,13-Dimethyl-3-Oxo-2-(2,2,2-Trifluoroethanoyl)-1,2,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-17-Yl] Ethanoate
• 分子式: C₂₃H₃₁F₃O₄
• 分子量: 428.49
• CAS 登录号: 1880-36-0
• 分子行输入简码 SMILES: [C@@H]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4CC(=O)C(C[C@]34C)C(=O)C(F)(F)F)C)OC(C)=O
• 国际化学标识码 InChI: 1S/C23H31F3O4/c1-12(27)30-19-7-6-16-14-5-4-13-10-18(28)15(20(29)23(24,25)26)11-22(13,3)17(14)8-9-21(16,19)2/h13-17,19H,4-11H2,1-3H3/t13-,14-,15?,16-,17-,19-,21-,22-/m0/s1
• 国际化学标识检索码 InChIKey: DEMBSTKGTUKIOV-KTCKLSTMSA-N

物理化学性质

• 密度: 1.233g/cm³ （计算值）
• 沸点: 466.14°C at 760 mmHg （计算值）
• 闪点: 227.266°C （计算值）