96-38-8 (甲基环戊二烯,Methylcyclopentadiene)

快速询单

结构式：

甲基环戊二烯MOL文件

CAS号：

96-38-8

中文名称：

甲基环戊二烯

英文名称：

Methylcyclopentadiene

分子式：

C₆H₈

分子量：

80.127721786499

甲基环戊二烯(96-38-8)名称与标识符

名称

英文别名：

Methylcyclopentadiene;5-methylcyclopenta-1,3-diene;5-Methyl-1,3-cyclopentadiene;1,3-Cyclopentadiene, 5-methyl-;X1DWO24VEA;Q22077211;96-38-8;5-Methylcyclopentadiene;QVRBGKYLLCLCHL-UHFFFAOYSA-N;CYCLOPENTADIENE, 5-METHYL-;DTXSID7048035;UNII-X1DWO24VEA;

标识符

InChIKey：

QVRBGKYLLCLCHL-UHFFFAOYSA-N

Inchi：

1S/C6H8/c1-6-4-2-3-5-6/h2-6H,1H3

SMILES：

C1(C)C=CC=C1

甲基环戊二烯(96-38-8)物化性质

计算特性

精确分子量 : 80.062600255g/mol
氢键供体数量 : 0
氢键受体数量 : 0
可旋转化学键数量 : 0
同位素质量 : 80.062600255g/mol
重原子数量 : 6
复杂度 : 76.2
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） : 2.2
拓扑分子极性表面积 : 0Å²

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96-38-8 (甲基环戊二烯,Methylcyclopentadiene)

甲基环戊二烯(96-38-8)名称与标识符

名称

标识符

甲基环戊二烯(96-38-8)物化性质

计算特性

甲基环戊二烯(96-38-8)相关文献

目录