4-[4-(3-氯苯基)-4-(吡咯烷-1-鎓-1-羰基)哌啶-1-鎓-1-基]-4-氟-1-苯基丁烷-1-酮草酸盐
[CAS# 2256-06-6]

基本信息

• 产品名称: 4-[4-(3-氯苯基)-4-(吡咯烷-1-鎓-1-羰基)哌啶-1-鎓-1-基]-4-氟-1-苯基丁烷-1-酮草酸盐
• 英文名: 4-[4-(3-Chlorophenyl)-4-(Pyrrolidin-1-Ium-1-Carbonyl)Piperidin-1-Ium-1-Yl]-4-Fluoro-1-Phenylbutan-1-One Oxalate
• 别名: 4-[4-(3-Chlorophenyl)-4-(Pyrrolidin-1-Ium-1-Carbonyl)Piperidin-1-Ium-1-Yl]-4-Fluoro-1-Phenyl-Butan-1-One; Oxalate; 4-[4-(3-Chlorophenyl)-4-[Oxo-(1-Pyrrolidin-1-Iumyl)Methyl]-1-Piperidin-1-Iumyl]-4-Fluoro-1-Phenylbutan-1-One; Oxalate; 4-[4-(3-Chlorophenyl)-4-Pyrrolidin-1-Ium-1-Ylcarbonyl-Piperidin-1-Ium-1-Yl]-4-Fluoro-1-Phenyl-Butan-1-One; Ethanedioate
• 分子式: C₂₈H₃₂ClFN₂O₆
• CAS 登录号: 2256-06-6
• 分子行输入简码 SMILES: C1=C(Cl)C=CC=C1C3(C(=O)[NH+]2CCCC2)CC[NH+](CC3)C(F)CCC(=O)C4=CC=CC=C4.O=C([O-])C([O-])=O
• 国际化学标识码 InChI: 1S/C26H30ClFN2O2.C2H2O4/c27-22-10-6-9-21(19-22)26(25(32)30-15-4-5-16-30)13-17-29(18-14-26)24(28)12-11-23(31)20-7-2-1-3-8-20;3-1(4)2(5)6/h1-3,6-10,19,24H,4-5,11-18H2;(H,3,4)(H,5,6)
• 国际化学标识检索码 InChIKey: CNEOZRIZTKXNDU-UHFFFAOYSA-N

物理化学性质

• 沸点: 622.8°C at 760 mmHg （计算值）
• 闪点: 330.4°C （计算值）