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68989-30-0 ((Diethyl glutarate)

结构式：

Diethyl glutarate结构式图片|68989-30-0结构式图片

Diethyl glutarateMOL文件

CAS号：

68989-30-0

英文名称：

Diethyl glutarate

分子式：

C₉H₁₆O₄

分子量：

188.220943450928

Diethyl glutarate(68989-30-0)名称与标识符

名称

英文别名：

DIETHYL GLUTARATE;Diethyl pentanedioate;Ethyl glutarate;Pentanedioic acid, diethyl ester;Glutaric acid diethyl ester;Glutaric acid, diethyl ester;84O6XW9RFE;pentanedioic acid diethyl ester;OUWSNHWQZPEFEX-UHFFFAOYSA-N;Pentanedioic acid, 1,5-diethyl ester;Glutaric acid diethyl;

标识符

InChIKey：

OUWSNHWQZPEFEX-UHFFFAOYSA-N

Inchi：

1S/C9H16O4/c1-3-12-8(10)6-5-7-9(11)13-4-2/h3-7H2,1-2H3

SMILES：

O(CC)C(CCCC(=O)OCC)=O

Diethyl glutarate(68989-30-0)物化性质

实验特性

沸点 : 236.5°Cat760mmHg
闪点 : 96.1°C
密度 : 1.022

计算特性

精确分子量 : 188.104859
氢键供体数量 : 0
氢键受体数量 : 4
可旋转化学键数量 : 8
同位素质量 : 188.104859
重原子数量 : 13
复杂度 : 147
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
拓扑分子极性表面积 : 52.6

Diethyl glutarate(68989-30-0)国际标准相关数据

EINECS：

8890

Diethyl glutarate(68989-30-0)相关文献

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9. Spirocyclisation reactions of diethyl pyridazine-4,5-dicarboxylate with 1,3-binucleophiles
Giorgio Adembri,Stefano Chimichi,Rodolfo Nesi,Mirella Scotton J. Chem. Soc. Perkin Trans. 1 1977 1020
10. 187. Infrared spectra and crystallinity. Part V. Dimethyl and diethyl esters of αω-dicarboxylic acids
P. J. Corish,W. H. T. Davison J. Chem. Soc. 1958 927

目录

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