丁二酸 1-[2-(2-氯-5-甲基苯氧基)-1-[[叔丁基氨基]甲基]乙基] 4-[2-[(1-氧代十六烷基)氧基]-1-[[(1-氧代十六烷基)氧基]甲基]乙基]酯盐酸盐(1:1)
[CAS# 99026-79-6]

基本信息

• 产品名称: 丁二酸 1-[2-(2-氯-5-甲基苯氧基)-1-[[叔丁基氨基]甲基]乙基] 4-[2-[(1-氧代十六烷基)氧基]-1-[[(1-氧代十六烷基)氧基]甲基]乙基]酯盐酸盐(1:1)
• 英文名: Butanedioic Acid 1-[2-(2-Chloro-5-Methylphenoxy)-1-[[(1,1-Dimethylethyl)Amino]Methyl]Ethyl]4-[2-[(1-Oxohexadecyl)Oxy]-1-[[(1-Oxohexadecyl)Oxy]Methyl]Ethyl] Ester Hydrochloride(1:1)
• 别名: [1-[(Tert-Butylamino)Methyl]-2-(2-Chloro-5-Methyl-Phenoxy)Ethyl] [2-Hexadecanoyloxy-1-(Hexadecanoyloxymethyl)Ethyl] Butanedioate Hydrochloride; Butanedioic Acid [1-[(Tert-Butylamino)Methyl]-2-(2-Chloro-5-Methylphenoxy)Ethyl] Ester [2-(1-Oxohexadecoxy)-1-(1-Oxohexadecoxymethyl)Ethyl] Ester Hydrochloride; Succinic Acid [1-[(Tert-Butylamino)Methyl]-2-(2-Chloro-5-Methyl-Phenoxy)Ethyl] Ester [2-Hexadecanoyloxy-1-(Hexadecanoyloxymethyl)Ethyl] Ester Hydrochloride
• 分子式: C₅₃H₉₃Cl₂NO₉
• 分子量: 959.23
• CAS 登录号: 99026-79-6
• 分子行输入简码 SMILES: [H+].C1=C(C=CC(=C1OCC(OC(=O)CCC(OC(COC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC)=O)CNC(C)(C)C)Cl)C.[Cl-]
• 国际化学标识码 InChI: 1S/C53H92ClNO9.ClH/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-49(56)61-42-46(43-62-50(57)34-32-30-28-26-24-22-20-18-16-14-12-10-8-2)64-52(59)38-37-51(58)63-45(40-55-53(4,5)6)41-60-48-39-44(3)35-36-47(48)54;/h35-36,39,45-46,55H,7-34,37-38,40-43H2,1-6H3;1H
• 国际化学标识检索码 InChIKey: SHTNCSPEDGTLDP-UHFFFAOYSA-N

物理化学性质

• 沸点: 840.5°C at 760 mmHg （计算值）
• 闪点: 462.1°C （计算值）