(8S,9R,10S,11S,13S,14S,17R)-9-氟-17-(2-氟乙酰基)-11,17-二羟基-10,13-二甲基-1,2,6,7,8,11,12,14,15,16-十氢环戊烯并[a]菲-3-酮
[CAS# 472-24-2]

基本信息

• 产品名称: (8S,9R,10S,11S,13S,14S,17R)-9-氟-17-(2-氟乙酰基)-11,17-二羟基-10,13-二甲基-1,2,6,7,8,11,12,14,15,16-十氢环戊烯并[a]菲-3-酮
• 英文名: (8S,9R,10S,11S,13S,14S,17R)-9-Fluoro-17-(2-Fluoroacetyl)-11,17-Dihydroxy-10,13-Dimethyl-1,2,6,7,8,11,12,14,15,16-Decahydrocyclopenta[a]Phenanthren-3-One
• 别名: (8S,9R,10S,11S,13S,14S,17R)-9-Fluoro-17-(2-Fluoro-1-Oxoethyl)-11,17-Dihydroxy-10,13-Dimethyl-1,2,6,7,8,11,12,14,15,16-Decahydrocyclopenta[A]Phenanthren-3-One; (8S,9R,10S,11S,13S,14S,17R)-9-Fluoro-17-(2-Fluoroethanoyl)-11,17-Dihydroxy-10,13-Dimethyl-1,2,6,7,8,11,12,14,15,16-Decahydrocyclopenta[A]Phenanthren-3-One; Nsc22845
• 分子式: C₂₁H₂₈F₂O₄
• 分子量: 382.45
• CAS 登录号: 472-24-2
• 分子行输入简码 SMILES: [C@]4([C@@]1([C@H]([C@H]3[C@](F)([C@@H](O)C1)[C@]2(C)C(=CC(CC2)=O)CC3)CC4)C)(O)C(CF)=O
• 国际化学标识码 InChI: 1S/C21H28F2O4/c1-18-7-5-13(24)9-12(18)3-4-15-14-6-8-20(27,17(26)11-22)19(14,2)10-16(25)21(15,18)23/h9,14-16,25,27H,3-8,10-11H2,1-2H3/t14-,15-,16-,18-,19-,20-,21-/m0/s1
• 国际化学标识检索码 InChIKey: HMQHDCRSYKWXAA-BULBTXNYSA-N

物理化学性质

• 密度: 1.302g/cm³ （计算值）
• 沸点: 536.401°C at 760 mmHg （计算值）
• 闪点: 278.205°C （计算值）