736971-55-4 (methyl 2-(2,6-dichlorobenzyl)-1H-imidazole-5-carboxylate,Methyl 2-(2,6-dichlorobenzyl)-1H-imidazole-5-carboxylate)

CAS号:
736971-55-4
中文名称:
methyl 2-(2,6-dichlorobenzyl)-1H-imidazole-5-carboxylate
英文名称:
Methyl 2-(2,6-dichlorobenzyl)-1H-imidazole-5-carboxylate
分子式:
C12H10Cl2N2O2
分子量:
285.126000881195

methyl 2-(2,6-dichlorobenzyl)-1H-imidazole-5-carboxylate(736971-55-4)名称与标识符

名称

中文别名:
2-(2,6-二氯苄基)-1H-咪唑-5-羧酸甲酯;
英文别名:
methyl 2-(2,6-dichlorobenzyl)-1H-imidazole-5-carboxylate;

标识符

InChIKey:
TUZPBDIFPMZOAG-UHFFFAOYSA-N
Inchi:
1S/C12H10Cl2N2O2/c1-18-12(17)10-6-15-11(16-10)5-7-8(13)3-2-4-9(7)14/h2-4,6H,5H2,1H3,(H,15,16)
SMILES:
ClC1C=CC=C(C=1CC1=NC=C(C(=O)OC)N1)Cl

methyl 2-(2,6-dichlorobenzyl)-1H-imidazole-5-carboxylate(736971-55-4)物化性质

计算特性

  • 氢键供体数量 : 1
  • 氢键受体数量 : 3
  • 可旋转化学键数量 : 4
  • 重原子数量 : 18
  • 复杂度 : 294
  • 拓扑分子极性表面积 : 55