HCID11482000

4-Azido-3-chlorobenzyl bromide

1-azido-4-(bromomethyl)-2-chlorobenzene

C7H5BrClN3246.49 g/molCAS 193887-70-6

查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准SMILES: [N-]=[N+]=Nc1ccc(CBr)cc1Cl
InChIKey: KWLVILKXNKDWCB-UHFFFAOYSA-N
分子式: C7H5BrClN3
平均分子量: 246.49 g/mol
单同位素质量: 244.93554

COMPUTED

结构计算性质

已同步

XLogP: 4
极性表面积: 14.4 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 2
重原子: 12
形式电荷: 0
复杂度: 193

ALIASES

名称与别名

共 8 条

4-AZIDO-3-CHLOROBENZYL BROMIDE193887-70-6DTXSID50467306RefChem:290199DTXCID404181251-azido-4-(bromomethyl)-2-chlorobenzenep-azido-m-chlorobenzyl bromideKWLVILKXNKDWCB-UHFFFAOYSA-N

REACTIONS

参与反应

7 条

uspto-grants-1999_12 · 10.6084/m9.figshare.5104873.v1 · US05998595

查看

uspto-grants-1999_12 · 10.6084/m9.figshare.5104873.v1 · US05998595

查看

uspto-grants-1999_12 · 10.6084/m9.figshare.5104873.v1 · US05998595

查看

uspto-grants-1999_12 · 10.6084/m9.figshare.5104873.v1 · US05998595

查看

Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

查看

Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

查看

Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D

查看