916504-81-9 ((1H-Benzimidazole-2-carboxylic acid, 1H-benzimidazol-2-ylmethyl ester)

CAS号:
916504-81-9
英文名称:
1H-Benzimidazole-2-carboxylic acid, 1H-benzimidazol-2-ylmethyl ester
分子式:
C16H12N4O2
分子量:
292.29208278656

1H-Benzimidazole-2-carboxylic acid, 1H-benzimidazol-2-ylmethyl ester(916504-81-9)名称与标识符

名称

英文别名:
1H-Benzimidazole-2-carboxylic acid, 1H-benzimidazol-2-ylmethyl ester;

标识符

InChIKey:
RXMMOOHQDNTLAE-UHFFFAOYSA-N
Inchi:
1S/C16H12N4O2/c21-16(15-19-12-7-3-4-8-13(12)20-15)22-9-14-17-10-5-1-2-6-11(10)18-14/h1-8H,9H2,(H,17,18)(H,19,20)
SMILES:
C1(C(OCC2NC3=CC=CC=C3N=2)=O)NC2=CC=CC=C2N=1

1H-Benzimidazole-2-carboxylic acid, 1H-benzimidazol-2-ylmethyl ester(916504-81-9)物化性质

实验特性

  • 沸点 : 617.1±57.0 °C(Predicted)
  • 熔点 : 145-146 °C(Solv: methanol (67-56-1))
  • 酸度系数(pKa) : 10.20±0.10(Predicted)
  • 密度 : 1.466±0.06 g/cm3(Predicted)