803680-36-6 ((1H-Benzimidazole-1-propanenitrile, 3-[1-(3-cyano-3,3-diphenylpropyl)-4-piperidinyl]-2,3-dihydro-2-oxo-)

CAS号:
803680-36-6
英文名称:
1H-Benzimidazole-1-propanenitrile, 3-[1-(3-cyano-3,3-diphenylpropyl)-4-piperidinyl]-2,3-dihydro-2-oxo-
分子式:
C31H31N5O
分子量:
489.610746622086

1H-Benzimidazole-1-propanenitrile, 3-[1-(3-cyano-3,3-diphenylpropyl)-4-piperidinyl]-2,3-dihydro-2-oxo-(803680-36-6)名称与标识符

名称

英文别名:
1H-Benzimidazole-1-propanenitrile, 3-[1-(3-cyano-3,3-diphenylpropyl)-4-piperidinyl]-2,3-dihydro-2-oxo-;

标识符

InChIKey:
SIIOZKZMCBWYCN-UHFFFAOYSA-N
Inchi:
1S/C31H31N5O/c32-19-9-20-35-28-14-7-8-15-29(28)36(30(35)37)27-16-21-34(22-17-27)23-18-31(24-33,25-10-3-1-4-11-25)26-12-5-2-6-13-26/h1-8,10-15,27H,9,16-18,20-23H2
SMILES:
C(C1C=CC=CC=1)(C1C=CC=CC=1)(C#N)CCN1CCC(N2C(N(C3=CC=CC=C23)CCC#N)=O)CC1

1H-Benzimidazole-1-propanenitrile, 3-[1-(3-cyano-3,3-diphenylpropyl)-4-piperidinyl]-2,3-dihydro-2-oxo-(803680-36-6)物化性质

实验特性

  • 沸点 : 692.016±55.00 °C(Press: 760.00 Torr)(predicted)
  • 酸度系数(pKa) : 8.213±0.10(predicted)
  • 密度 : 1.211±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)