2,16-二哌啶雄甾烷-3,17-二醇二特戊酸酯
[CAS# 63665-41-8]

基本信息

• 产品名称: 2,16-二哌啶雄甾烷-3,17-二醇二特戊酸酯
• 英文名: 2,16-Dipiperidinoandrostane-3,17-Diol Dipivalate
• 别名: [(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-3-(2,2-Dimethylpropanoyloxy)-10,13-Dimethyl-2,16-Bis(1-Piperidyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl] 2,2-Dimethylpropanoate; 2,2-Dimethylpropanoic Acid [(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-3-(2,2-Dimethyl-1-Oxopropoxy)-10,13-Dimethyl-2,16-Bis(1-Piperidyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl] Ester; 2,2-Dimethylpropionic Acid [(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-10,13-Dimethyl-2,16-Dipiperidino-3-Pivaloyloxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl] Ester
• 分子式: C₃₉H₆₆N₂O₄
• 分子量: 626.96
• CAS 登录号: 63665-41-8
• 分子行输入简码 SMILES: [C@H]1([C@H](C[C@]3([C@H](C1)CC[C@H]4[C@@H]2C[C@@H]([C@@H]([C@@]2(C)CC[C@H]34)OC(C(C)(C)C)=O)N5CCCCC5)C)N6CCCCC6)OC(C(C)(C)C)=O
• 国际化学标识码 InChI: 1S/C39H66N2O4/c1-36(2,3)34(42)44-32-23-26-15-16-27-28(39(26,8)25-31(32)41-21-13-10-14-22-41)17-18-38(7)29(27)24-30(40-19-11-9-12-20-40)33(38)45-35(43)37(4,5)6/h26-33H,9-25H2,1-8H3/t26-,27+,28-,29-,30-,31-,32-,33-,38-,39-/m0/s1
• 国际化学标识检索码 InChIKey: UAXYDQGRJRUBNC-ZMFKFFRCSA-N

物理化学性质

• 密度: 1.089g/cm³ （计算值）
• 沸点: 641.712°C at 760 mmHg （计算值）
• 闪点: 341.895°C （计算值）