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1,3-Benzodioxole-5-butanenitrile,a-(3,4-dimethoxyphenyl)-g-oxo

更新时间:2025-10-11 14:41:41

1,3-Benzodioxole-5-butanenitrile,a-(3,4-dimethoxyphenyl)-g-oxo结构式
1,3-Benzodioxole-5-butanenitrile,a-(3,4-dimethoxyphenyl)-g-oxo结构式
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常用名 1,3-Benzodioxole-5-butanenitrile,a-(3,4-dimethoxyphenyl)-g-oxo 英文名 1,3-Benzodioxole-5-butanenitrile,a-(3,4-dimethoxyphenyl)-g-oxo
CAS号 54022-58-1 分子量 339.34200
密度 1.266g/cm3 沸点 562.2ºC at 760 mmHg
分子式 C19H17NO5 熔点 N/A
MSDS N/A 闪点 241.6ºC

 名称

英文名 4-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-4-oxobutanenitrile

 物理化学性质

密度 1.266g/cm3
沸点 562.2ºC at 760 mmHg
分子式 C19H17NO5
分子量 339.34200
闪点 241.6ºC
精确质量 339.11100
PSA 77.78000
LogP 3.31268
InChIKey DATWEMXHHHBSKR-UHFFFAOYSA-N
SMILES COc1ccc(C(C#N)CC(=O)c2ccc3c(c2)OCO3)cc1OC
折射率 1.582

 合成线路

~%

1,3-Benzodioxole-5-butanenitrile,a-(3,4-dimethoxyphenyl)-g-oxo结构式

1,3-Benzodioxol...

54022-58-1

文献:Gopinath et al. Journal of the Chemical Society, 1959 , p. 4012 Full Text Show Details Arthur; Ng Journal of the Chemical Society, 1959 , p. 4010

~%

1,3-Benzodioxole-5-butanenitrile,a-(3,4-dimethoxyphenyl)-g-oxo结构式

1,3-Benzodioxol...

54022-58-1

文献:Ishii, Hisashi; Ishikawa, Tsutomu; Chen, Ih-Sheng; Ichikawa, Yuh-Ichiro Heterocycles, 1984 , vol. 21, # 2 p. 711

~%

1,3-Benzodioxole-5-butanenitrile,a-(3,4-dimethoxyphenyl)-g-oxo结构式

1,3-Benzodioxol...

54022-58-1

文献:Ishii, Hisashi; Ishikawa, Tsutomu; Chen, Ih-Sheng; Ichikawa, Yuh-Ichiro Heterocycles, 1984 , vol. 21, # 2 p. 711

~%

1,3-Benzodioxole-5-butanenitrile,a-(3,4-dimethoxyphenyl)-g-oxo结构式

1,3-Benzodioxol...

54022-58-1

文献:Ishii, Hisashi; Ishikawa, Tsutomu; Chen, Ih-Sheng; Ichikawa, Yuh-Ichiro Heterocycles, 1984 , vol. 21, # 2 p. 711

~%

1,3-Benzodioxole-5-butanenitrile,a-(3,4-dimethoxyphenyl)-g-oxo结构式

1,3-Benzodioxol...

54022-58-1

文献:Richardson et al. Journal of the Chemical Society, 1937 , p. 835,839

 靶点实验

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External Id:CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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External Id:TDP1100
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