Chem
J-GLOBAL ID：200907094151512857
Nikkaji number：J134.972D
3,3-Dimethoxypropionitrile
3,3-ジメトキシプロピオニトリル
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C5H9NO2
Molecular formula furigana： C5-H9-N-O2
Molecular weight： 115.132
InChI：
InChI=1S/C5H9NO2/c1-7-5(8-2)3-4-6/h5H,3H2,1-2H3
InChI key：
JYHSJQNYYLGMEI-UHFFFAOYSA-N
SMILES：
COC(CC#N)OC
Systematic name (5)：
- 3,3-ジメトキシプロパンニトリル
- シアノアセトアルデヒドジメチルアセタール
- 3,3-ジメトキシプロピオニトリル
- 3,3-ジメトキシプロピオノニトリル
- 3,3-dimethoxypropanenitrile
- 3,3-Dimethoxypropiononitrile
- 3,3-Dimethoxypropionitrile
- 3,3-Dimethoxypropanenitrile
- Cyanoacetaldehyde dimethyl acetal
Regulation number (3)：
- 2-(6)-1181
- EINECS2608421
- (2)-3592
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