46122-12-7 ((1-Hexylpyridinium)

快速询单

结构式：

1-HexylpyridiniumMOL文件

CAS号：

46122-12-7

英文名称：

1-Hexylpyridinium

分子式：

C₁₁H₁₈N

分子量：

164.26732301712

1-Hexylpyridinium(46122-12-7)名称与标识符

名称

英文别名：

LND9U4X7XT;1-hexylpyridin-1-ium;1-hexylpyridinium;CHEMBL1195735;DTXSID6048098;46122-12-7;n-hexylpyridinium;SCHEMBL16351389;A833639;NCGC00248729-01;SCHEMBL572816;Pyridinium, 1-hexyl-;DTXCID7028069;NCGC00248729-02;

标识符

InChIKey：

AMKUSFIBHAUBIJ-UHFFFAOYSA-N

Inchi：

1S/C11H18N/c1-2-3-4-6-9-12-10-7-5-8-11-12/h5,7-8,10-11H,2-4,6,9H2,1H3/q+1

SMILES：

[N+]1(C=CC=CC=1)CCCCCC

1-Hexylpyridinium(46122-12-7)物化性质

计算特性

精确分子量 : 164.143924578g/mol
氢键供体数量 : 0
氢键受体数量 : 0
可旋转化学键数量 : 5
同位素质量 : 164.143924578g/mol
重原子数量 : 12
复杂度 : 95.2
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） : 3.3
拓扑分子极性表面积 : 3.9Å²

1-Hexylpyridinium(46122-12-7)相关文献

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46122-12-7 ((1-Hexylpyridinium)

1-Hexylpyridinium(46122-12-7)名称与标识符

名称

标识符

1-Hexylpyridinium(46122-12-7)物化性质

计算特性

1-Hexylpyridinium(46122-12-7)相关文献

目录