6-[3-[2-(3,4-二甲氧基苯基)乙基氨基]-2-羟基-丙氧基]-8-硫杂双环[3.3.0]辛-6,9-二烯-7-羧酸盐酸盐
[CAS# 85462-88-0]

基本信息

• 产品名称: 6-[3-[2-(3,4-二甲氧基苯基)乙基氨基]-2-羟基-丙氧基]-8-硫杂双环[3.3.0]辛-6,9-二烯-7-羧酸盐酸盐
• 英文名: 6-[3-[2-(3,4-Dimethoxyphenyl)Ethylamino]-2-Hydroxy-Propoxy]-8-Thiabicyclo[3.3.0]Octa-6,9-Diene-7-Carboxylic Acid Hydrochloride
• 别名: 3-[3-[2-(3,4-Dimethoxyphenyl)Ethylamino]-2-Hydroxy-Propoxy]-5,6-Dihydro-4H-Cyclopenta[D]Thiophene-2-Carboxylic Acid Hydrochloride; 3-[3-(Homoveratrylamino)-2-Hydroxy-Propoxy]-5,6-Dihydro-4H-Cyclopenta[D]Thiophene-2-Carboxylic Acid Hydrochloride; 4H-Cyclopenta(B)Thiophene-2-Carboxylic Acid, 5,6-Dihydro-3-(3-((2-(3,4-Dimethoxyphenyl)Ethyl)Amino)-2-Hydroxypropoxy)-, Hydrochloride
• 分子式: C₂₁H₂₈ClNO₆S
• 分子量: 457.97
• CAS 登录号: 85462-88-0
• 分子行输入简码 SMILES: [H+].C3=C(CCNCC(O)COC1=C(SC2=C1CCC2)C(O)=O)C=CC(=C3OC)OC.[Cl-]
• 国际化学标识码 InChI: 1S/C21H27NO6S.ClH/c1-26-16-7-6-13(10-17(16)27-2)8-9-22-11-14(23)12-28-19-15-4-3-5-18(15)29-20(19)21(24)25;/h6-7,10,14,22-23H,3-5,8-9,11-12H2,1-2H3,(H,24,25);1H
• 国际化学标识检索码 InChIKey: BHTQOAJCXATTMY-UHFFFAOYSA-N

物理化学性质

• 沸点: 665.9°C at 760 mmHg （计算值）
• 闪点: 356.5°C （计算值）