胆固醇磷酰二甲基乙醇胺
[CAS# 120087-00-5]

基本信息

• 产品名称: 胆固醇磷酰二甲基乙醇胺
• 英文名: Cholesterylphosphoryldimethylethanolamine
• 别名: [2-Dimethylamino-1-[(10R,13R)-17-[(1R)-1,5-Dimethylhexyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl]-1-Hydroxy-Ethyl]Phosphonic Acid; [2-Dimethylamino-1-[(10R,13R)-17-[(1R)-1,5-Dimethylhexyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl]-1-Hydroxyethyl]Phosphonic Acid; [2-Dimethylamino-1-[(10R,13R)-10,13-Dimethyl-17-[(2R)-6-Methylheptan-2-Yl]-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl]-1-Hydroxy-Ethyl]Phosphonic Acid
• 分子式: C₃₁H₅₆NO₄P
• 分子量: 537.76
• CAS 登录号: 120087-00-5
• 分子行输入简码 SMILES: [C@]34(C2C(C1[C@@](C(CC1)[C@@H](CCCC(C)C)C)(CC2)C)CC=C3CC(C([P](=O)(O)O)(O)CN(C)C)CC4)C
• 国际化学标识码 InChI: 1S/C31H56NO4P/c1-21(2)9-8-10-22(3)26-13-14-27-25-12-11-23-19-24(31(33,20-32(6)7)37(34,35)36)15-17-29(23,4)28(25)16-18-30(26,27)5/h11,21-22,24-28,33H,8-10,12-20H2,1-7H3,(H2,34,35,36)/t22-,24?,25?,26?,27?,28?,29+,30-,31?/m1/s1
• 国际化学标识检索码 InChIKey: WJBFTCUMOCAKLX-DONHXRCRSA-N

物理化学性质

• 密度: 1.115g/cm³ （计算值）
• 沸点: 641.348°C at 760 mmHg （计算值）
• 闪点: 341.675°C （计算值）