97507-71-6 ((Selenonium,(carboxymethyl)dimethyl-)

快速询单

结构式：

Selenonium,(carboxymethyl)dimethyl-MOL文件

CAS号：

97507-71-6

英文名称：

Selenonium,(carboxymethyl)dimethyl-

分子式：

C₄H₉O₂Se

分子量：

168.073060750961

Selenonium,(carboxymethyl)dimethyl-(97507-71-6)名称与标识符

名称

英文别名：

Selenonium,(carboxymethyl)dimethyl-;carboxymethyl(dimethyl)selanium;selenobetaine;97507-71-6;DTXSID30243009;

标识符

InChIKey：

CXVASVNWFJSSHX-UHFFFAOYSA-O

Inchi：

1S/C4H8O2Se/c1-7(2)3-4(5)6/h3H2,1-2H3/p+1

SMILES：

[Se+](C)(C)CC(=O)O

Selenonium,(carboxymethyl)dimethyl-(97507-71-6)物化性质

实验特性

沸点 : °Cat760mmHg
闪点 : °C

计算特性

精确分子量 : 168.976776
氢键供体数量 : 1
氢键受体数量 : 2
可旋转化学键数量 : 2
同位素质量 : 168.976776
重原子数量 : 7
复杂度 : 70.1
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） : 无
互变异构体数量 : 无
表面电荷 : 1
拓扑分子极性表面积 : 37.3

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