9-氟-11beta,17,21-三羟基-16beta-甲基孕甾-1,4-二烯-3,20-二酮 21-特戊酸酯
[CAS# 52619-02-0]

基本信息

• 产品名称: 9-氟-11beta,17,21-三羟基-16beta-甲基孕甾-1,4-二烯-3,20-二酮 21-特戊酸酯
• 英文名: 9-Fluoro-11beta,17,21-Trihydroxy-16beta-Methylpregna-1,4-Diene-3,20-Dione 21-Pivalate
• 别名: [2-[(8S,9R,10S,11S,13S,14S,16S,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-Dimethylpropanoate; 2,2-Dimethylpropanoic Acid [2-[(8S,9R,10S,11S,13S,14S,16S,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-Dimethylpropionic Acid [2-[(8S,9R,10S,11S,13S,14S,16S,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: C₂₇H₃₇FO₆
• 分子量: 476.58
• CAS 登录号: 52619-02-0
• EINECS 登录号: 258-049-0
• 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(C)(C)C)C
• 国际化学标识码 InChI: 1S/C27H37FO6/c1-15-11-19-18-8-7-16-12-17(29)9-10-24(16,5)26(18,28)20(30)13-25(19,6)27(15,33)21(31)14-34-22(32)23(2,3)4/h9-10,12,15,18-20,30,33H,7-8,11,13-14H2,1-6H3/t15-,18-,19-,20-,24-,25-,26-,27-/m0/s1
• 国际化学标识检索码 InChIKey: XMQRFWOHEPJZPS-WDTKEXHNSA-N

物理化学性质

• 密度: 1.245g/cm³ （计算值）
• 沸点: 598.623°C at 760 mmHg （计算值）
• 闪点: 315.836°C （计算值）