7-[(2S,3E,5Z)-10-(4-乙酰基-3-羟基-2-丙基苯氧基)-1-羟基-1-[3-(三氟甲基)苯基]癸-3,5-二烯-2-基]硫基-4-氧代苯并吡喃-2-羧酸
[CAS# 151581-24-7]

基本信息

• 产品名称: 7-[(2S,3E,5Z)-10-(4-乙酰基-3-羟基-2-丙基苯氧基)-1-羟基-1-[3-(三氟甲基)苯基]癸-3,5-二烯-2-基]硫基-4-氧代苯并吡喃-2-羧酸
• 英文名: 7-[(2S,3E,5Z)-10-(4-Acetyl-3-Hydroxy-2-Propylphenoxy)-1-Hydroxy-1-[3-(Trifluoromethyl)Phenyl]Deca-3,5-Dien-2-Yl]Sulfanyl-4-Oxochromene-2-Carboxylic Acid
• 别名: 7-[(1S,2E,4Z)-9-(4-Acetyl-3-Hydroxy-2-Propyl-Phenoxy)-1-[Hydroxy-[3-(Trifluoromethyl)Phenyl]Methyl]Nona-2,4-Dienyl]Sulfanyl-4-Oxo-Chromene-2-Carboxylic Acid; 7-[[(1S,2E,4Z)-9-(4-Acetyl-3-Hydroxy-2-Propylphenoxy)-1-[Hydroxy-[3-(Trifluoromethyl)Phenyl]Methyl]Nona-2,4-Dienyl]Thio]-4-Oxo-2-Chromenecarboxylic Acid; 7-[[(1S,2E,4Z)-9-(4-Acetyl-3-Hydroxy-2-Propyl-Phenoxy)-1-[Hydroxy-[3-(Trifluoromethyl)Phenyl]Methyl]Nona-2,4-Dienyl]Thio]-4-Keto-Chromene-2-Carboxylic Acid
• 分子式: C₃₈H₃₇F₃O₈S
• 分子量: 710.76
• CAS 登录号: 151581-24-7
• 分子行输入简码 SMILES: [C@H](SC2=CC=C1C(C=C(OC1=C2)C(=O)O)=O)(\C=C\C=C/CCCCOC3=CC=C(C(=C3CCC)O)C(=O)C)C(C4=CC=CC(=C4)C(F)(F)F)O
• 国际化学标识码 InChI: 1S/C38H37F3O8S/c1-3-11-29-31(18-17-27(23(2)42)36(29)45)48-19-9-7-5-4-6-8-14-34(35(44)24-12-10-13-25(20-24)38(39,40)41)50-26-15-16-28-30(43)22-33(37(46)47)49-32(28)21-26/h4,6,8,10,12-18,20-22,34-35,44-45H,3,5,7,9,11,19H2,1-2H3,(H,46,47)/b6-4-,14-8+/t34-,35?/m0/s1
• 国际化学标识检索码 InChIKey: IXJCHVMUTFCRBH-MGVWHGJXSA-N

物理化学性质

• 密度: 1.379g/cm³ （计算值）
• 沸点: 820.92°C at 760 mmHg （计算值）
• 闪点: 450.276°C （计算值）