174257-23-9 ((1-Piperidinecarboxylic acid,4-[[1-[2-(3-methylphenyl)ethyl]-1H-imidazol-2-yl]carbonyl]-, ethyl ester)

CAS号:
174257-23-9
英文名称:
1-Piperidinecarboxylic acid,4-[[1-[2-(3-methylphenyl)ethyl]-1H-imidazol-2-yl]carbonyl]-, ethyl ester
分子式:
C21H27N3O3
分子量:
369.45738530159

1-Piperidinecarboxylic acid,4-[[1-[2-(3-methylphenyl)ethyl]-1H-imidazol-2-yl]carbonyl]-, ethyl ester(174257-23-9)名称与标识符

名称

英文别名:
1-Piperidinecarboxylic acid,4-[[1-[2-(3-methylphenyl)ethyl]-1H-imidazol-2-yl]carbonyl]-, ethyl ester;1-Piperidinecarboxylic acid, 4-[[1-[2-(3-methylphenyl)ethyl]-1H-imidazol-2-yl]carbonyl]-, ethyl ester;

标识符

InChIKey:
BBIIRZHGWWVVJW-UHFFFAOYSA-N
Inchi:
1S/C21H27N3O3/c1-3-27-21(26)24-12-8-18(9-13-24)19(25)20-22-10-14-23(20)11-7-17-6-4-5-16(2)15-17/h4-6,10,14-15,18H,3,7-9,11-13H2,1-2H3
SMILES:
N1(C(OCC)=O)CCC(C(C2N(CCC3=CC=CC(C)=C3)C=CN=2)=O)CC1

1-Piperidinecarboxylic acid,4-[[1-[2-(3-methylphenyl)ethyl]-1H-imidazol-2-yl]carbonyl]-, ethyl ester(174257-23-9)物化性质

实验特性

  • PSA : 64.43
  • 沸点 : 552.1±60.0 °C(Predicted)
  • 酸度系数(pKa) : 4.01±0.31(Predicted)
  • 密度 : 1.18±0.1 g/cm3(Predicted)

计算特性

  • 精确分子量 : 369.20541