1331-28-8 (氯代苯乙烯,chlorostyrene)

快速询单

结构式：

氯代苯乙烯MOL文件

CAS号：

1331-28-8

中文名称：

氯代苯乙烯

英文名称：

chlorostyrene

分子式：

C₈H₇Cl

分子量：

138.59418129921

氯代苯乙烯(1331-28-8)名称与标识符

名称

英文别名：

chlorostyrene;chlorovinylbenzene;(1-chloroethenyl)benzene;1-chloro-2-ethenylbenzene;Benzene, chloroethenyl-;Styrene, chloro-;Chlorvinylbenzol (o, m, p);

标识符

InChIKey：

SBYMUDUGTIKLCR-VOTSOKGWSA-N

Inchi：

1S/C8H7Cl/c9-7-6-8-4-2-1-3-5-8/h1-7H/b7-6+

SMILES：

Cl/C=C/C1C=CC=CC=1

氯代苯乙烯(1331-28-8)物化性质

实验特性

PSA : 0
折射率 : 1.5659 (estimate)
沸点 : 189.97°C (estimate)
熔点 : -23.4°C (estimate)
密度 : 1.1037 (estimate)

计算特性

精确分子量 : 138.02371
氢键供体数量 : 0
氢键受体数量 : 0
可旋转化学键数量 : 1
同位素质量 : 138.0236279g/mol
重原子数量 : 9
复杂度 : 90.7
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 : 1
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） : 2.9
拓扑分子极性表面积 : 0Å²

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