[1R-(1alpha,4abeta,4balpha,10a.alpha)]-1,2,3,4,4a,4b,5,9,10,10alpha-十氢-7-异丙基-1,4alpha-二甲基菲-1-羧酸钠
[CAS# 51590-83-1]

基本信息

• 产品名称: [1R-(1alpha,4abeta,4balpha,10a.alpha)]-1,2,3,4,4a,4b,5,9,10,10alpha-十氢-7-异丙基-1,4alpha-二甲基菲-1-羧酸钠
• 英文名: Sodium [1R-(1alpha,4abeta,4balpha,10a.alpha)]-1,2,3,4,4a,4b,5,9,10,10alpha-Decahydro-7-Isopropyl-1,4alpha-Dimethylphenanthren-1-Carboxylate
• 别名: Sodium (1R,4Ar,4Bs,10Ar)-7-Isopropyl-1,4A-Dimethyl-2,3,4,4B,5,9,10,10A-Octahydrophenanthrene-1-Carboxylate; Sodium (1R-(1Alpha,4Abeta,4Balpha,10Aalpha))-1,2,3,4,4A,4B,5,9,10,10A-Decahydro-7-Isopropyl-1,4A-Dimethylphenanthren-1-Carboxylate
• 分子式: C₂₀H₂₉NaO₂
• 分子量: 324.44
• CAS 登录号: 51590-83-1
• EINECS 登录号: 257-301-7
• 分子行输入简码 SMILES: [C@]12([C@H]([C@@](CCC1)(C([O-])=O)C)CCC3=CC(=CC[C@H]23)C(C)C)C.[Na+]
• 国际化学标识码 InChI: 1S/C20H30O2.Na/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22;/h6,12-13,16-17H,5,7-11H2,1-4H3,(H,21,22);/q;+1/p-1/t16-,17+,19+,20+;/m0./s1
• 国际化学标识检索码 InChIKey: PAZFWGSJMSOQLQ-XTICBAGASA-M

物理化学性质

• 沸点: 429.4°C at 760 mmHg （计算值）
• 闪点: 204.6°C （计算值）