162358-08-9
中文名称
二乙基2-乙酰胺基-2-(4-辛基苯乙基)丙二酸酯
英文名称
diethyl 2-acetamido-2-(4-octylphenethyl)malonate
CAS
162358-08-9
分子式
C25H39NO5
分子量
433.58
MOL 文件
162358-08-9.mol
更新日期
2025/06/30 07:57:13
162358-08-9 结构式
基本信息
中文别名
芬戈莫德杂质32-乙酰胺基-2-(4-辛基苯乙基)丙二酸二乙酯
2-乙酰氨基-2-(4-辛基苯乙基)丙二醇二乙酯
二乙基2-乙酰胺基-2-(4-辛基苯乙基)丙二酸酯
2-乙酰氨基-2-(2-(4-辛基苯基)乙基)丙二酸二乙酯
英文别名
Fingolimod Imp.3Fingolimod Impurity 25
Fingolimod N-Acetyl Diethyl Ester
diethyl 2-acetamido-2-(4-octylphenethyl)malote
diethyl 2-acetamido-2-(4-octylphenethyl)malonate
Diethyl 2-(acetamido)-2-(2-(4-octylphenyl)ethyl)propanedioate
Propanedioic acid, (acetylamino)[2-(4-octylphenyl)ethyl]-, diethyl ester
2-(AcetylaMino)-2-[2-(4-octylphenyl)ethyl]propanedioic Acid 1,3-Diethyl Ester
Propanedioic acid,2-(acetylamino)-2-[2-(4-octylphenyl)ethyl]-, 1,3-diethyl ester
物理化学性质
熔点57-58°C
沸点570.7±50.0 °C(Predicted)
密度1.043
储存条件2-8°C
溶解度Chloroform (Slightly), DMSO (Slightly, Heated), Ethyl Acetate (Slightly)
酸度系数(pKa)12.17±0.46(Predicted)
形态Solid
颜色White to Pale Yellow
InChIInChI=1S/C25H39NO5/c1-5-8-9-10-11-12-13-21-14-16-22(17-15-21)18-19-25(26-20(4)27,23(28)30-6-2)24(29)31-7-3/h14-17H,5-13,18-19H2,1-4H3,(H,26,27)
InChIKeyRYOKCHIAMHPMLV-UHFFFAOYSA-N
SMILESC(OCC)(=O)C(NC(C)=O)(CCC1=CC=C(CCCCCCCC)C=C1)C(OCC)=O
