[2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-氟-11,17-二羟基-10,13,16-三甲基-3-氧代-6,7,8,11,12,14,15,16-八氢环戊烯并[a]菲-17-基]-2-氧代乙基]2,2-二丁基己酸酯
[CAS# 78901-95-8]

基本信息

• 产品名称: [2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-氟-11,17-二羟基-10,13,16-三甲基-3-氧代-6,7,8,11,12,14,15,16-八氢环戊烯并[a]菲-17-基]-2-氧代乙基]2,2-二丁基己酸酯
• 英文名: [2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-Fluoro-11,17-Dihydroxy-10,13,16-Trimethyl-3-Oxo-6,7,8,11,12,14,15,16-Octahydrocyclopenta[a]Phenanthren-17-Yl]-2-Oxoethyl] 2,2-Dibutylhexanoate
• 别名: [2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-Fluoro-11,17-Dihydroxy-10,13,16-Trimethyl-3-Oxo-6,7,8,11,12,14,15,16-Octahydrocyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] 2,2-Dibutylhexanoate; 2,2-Dibutylhexanoic Acid [2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-Fluoro-11,17-Dihydroxy-10,13,16-Trimethyl-3-Oxo-6,7,8,11,12,14,15,16-Octahydrocyclopenta[A]Phenanthren-17-Yl]-2-Oxoethyl] Ester; 2,2-Dibutylhexanoic Acid [2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-Fluoro-11,17-Dihydroxy-3-Keto-10,13,16-Trimethyl-6,7,8,11,12,14,15,16-Octahydrocyclopenta[A]Phenanthren-17-Yl]-2-Keto-Ethyl] Ester
• 分子式: C₃₆H₅₅FO₆
• 分子量: 602.83
• CAS 登录号: 78901-95-8
• 分子行输入简码 SMILES: [C@H]34[C@H]2[C@@](F)([C@@]1(C(=CC(=O)C=C1)CC2)C)[C@@H](O)C[C@@]3([C@](O)([C@@H](C4)C)C(=O)COC(=O)C(CCCC)(CCCC)CCCC)C
• 国际化学标识码 InChI: 1S/C36H55FO6/c1-7-10-16-34(17-11-8-2,18-12-9-3)31(41)43-23-30(40)36(42)24(4)20-28-27-14-13-25-21-26(38)15-19-32(25,5)35(27,37)29(39)22-33(28,36)6/h15,19,21,24,27-29,39,42H,7-14,16-18,20,22-23H2,1-6H3/t24-,27+,28+,29+,32+,33+,35+,36+/m1/s1
• 国际化学标识检索码 InChIKey: KTCHQTXKNXKRDO-OOQKOAPDSA-N

物理化学性质

• 密度: 1.143g/cm³ （计算值）
• 沸点: 684.641°C at 760 mmHg （计算值）
• 闪点: 367.858°C （计算值）