3-[2-(1-苄基-3,5-二氧代-2-苯基-1,2,4-三唑烷-4-基)-4,4-二甲基-3-氧代戊酰基氨基]-4-氯苯甲酸1-十二烷氧基碳基乙酯
[CAS# 71297-15-9]

基本信息

• 产品名称: 3-[2-(1-苄基-3,5-二氧代-2-苯基-1,2,4-三唑烷-4-基)-4,4-二甲基-3-氧代戊酰基氨基]-4-氯苯甲酸1-十二烷氧基碳基乙酯
• 英文名: 3-[2-(1-Benzyl-3,5-Dioxo-2-Phenyl-1,2,4-Triazolidin-4-Yl)-4,4-Dimethyl-3-Oxovalerylamino]-4-Chlorobenzoic Acid 1-Dodecyloxycarbonylethyl Ester
• 别名: (2-Dodecoxy-1-Methyl-2-Oxo-Ethyl) 4-Chloro-3-[[2-[3,5-Dioxo-1-Phenyl-2-(Phenylmethyl)-1,2,4-Triazolidin-4-Yl]-4,4-Dimethyl-3-Oxo-Pentanoyl]Amino]Benzoate; 4-Chloro-3-[[2-[3,5-Dioxo-1-Phenyl-2-(Phenylmethyl)-1,2,4-Triazolidin-4-Yl]-4,4-Dimethyl-1,3-Dioxopentyl]Amino]Benzoic Acid (2-Dodecoxy-1-Methyl-2-Oxoethyl) Ester; 3-[[2-[1-(Benzyl)-3,5-Diketo-2-Phenyl-1,2,4-Triazolidin-4-Yl]-3-Keto-4,4-Dimethyl-Pentanoyl]Amino]-4-Chloro-Benzoic Acid (2-Keto-2-Lauryloxy-1-Methyl-Ethyl) Ester
• 分子式: C₄₄H₅₅ClN₄O₈
• 分子量: 803.39
• CAS 登录号: 71297-15-9
• 分子行输入简码 SMILES: C1=CC(=CC(=C1Cl)NC(=O)C(N2C(=O)N(N(C2=O)C3=CC=CC=C3)CC4=CC=CC=C4)C(=O)C(C)(C)C)C(=O)OC(C(=O)OCCCCCCCCCCCC)C
• 国际化学标识码 InChI: 1S/C44H55ClN4O8/c1-6-7-8-9-10-11-12-13-14-21-28-56-40(52)31(2)57-41(53)33-26-27-35(45)36(29-33)46-39(51)37(38(50)44(3,4)5)48-42(54)47(30-32-22-17-15-18-23-32)49(43(48)55)34-24-19-16-20-25-34/h15-20,22-27,29,31,37H,6-14,21,28,30H2,1-5H3,(H,46,51)
• 国际化学标识检索码 InChIKey: ONXHKHVNPZCHFB-UHFFFAOYSA-N

物理化学性质

• 密度: 1.22g/cm³ （计算值）