4745-43-1 ((1,3,2-Dioxathiolane)

快速询单

结构式：

1,3,2-DioxathiolaneMOL文件

CAS号：

4745-43-1

英文名称：

1,3,2-Dioxathiolane

分子式：

C₂H₄O₂S

分子量：

92.1169595718384

1,3,2-Dioxathiolane(4745-43-1)名称与标识符

名称

英文别名：

1,3,2-dioxathiolane;DTXSID10455269;DTXCID00406088;4745-43-1;

标识符

InChIKey：

QGVDSWMSHDZOMW-UHFFFAOYSA-N

Inchi：

1S/C2H4O2S/c1-2-4-5-3-1/h1-2H2

SMILES：

S1OCCO1

1,3,2-Dioxathiolane(4745-43-1)物化性质

计算特性

精确分子量 : 91.99320054Da
氢键供体数量 : 0
氢键受体数量 : 3
可旋转化学键数量 : 0
同位素质量 : 91.99320054Da
重原子数量 : 5
复杂度 : 26.8
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） : 0.3
拓扑分子极性表面积 : 43.8Å²

1,3,2-Dioxathiolane(4745-43-1)相关文献

1. The crystal structure of some 2-oxo-1,3,2-dioxathiolanes
Gordon Lowe,Salvatore J. Salamone,Richard H. Jones J. Chem. Soc. Chem. Commun. 1984 262
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9. Enantiomeric chiral [16O,17O,18O]sulphate esters
Gordon Lowe,Salvatore J. Salamone J. Chem. Soc. Chem. Commun. 1984 466
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4745-43-1 ((1,3,2-Dioxathiolane)

1,3,2-Dioxathiolane(4745-43-1)名称与标识符

名称

标识符

1,3,2-Dioxathiolane(4745-43-1)物化性质

计算特性

1,3,2-Dioxathiolane(4745-43-1)相关文献

目录