244-57-5 (1H咔唑,1H-Carbazole)

快速询单

结构式：

1H咔唑MOL文件

CAS号：

244-57-5

中文名称：

1H咔唑

英文名称：

1H-Carbazole

分子式：

C₁₂H₉N

分子量：

167.206562757492

1H咔唑(244-57-5)名称与标识符

名称

英文别名：

1H-Carbazole;DTXSID40429534;Q27116824;CHEBI:36423;244-57-5;SCHEMBL272379;

标识符

InChIKey：

UFLWECJWSGWVHB-UHFFFAOYSA-N

Inchi：

1S/C12H9N/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-7H,8H2

SMILES：

N1C2C=CC=CC=2C2=CC=CCC=12

1H咔唑(244-57-5)物化性质

实验特性

PSA : 12.36

计算特性

精确分子量 : 167.07357
氢键供体数量 : 0
氢键受体数量 : 1
可旋转化学键数量 : 0
同位素质量 : 167.073499291g/mol
重原子数量 : 13
复杂度 : 309
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : 2.4
拓扑分子极性表面积 : 12.4Å²

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