Chem
J-GLOBAL ID：200907056002161180
Nikkaji number：J1.664.628H
3-(1,3-Benzodioxole-5-yloxy)propiononitrile
3-(1,3-ベンゾジオキソール-5-イルオキシ)プロピオノニトリル
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： C10H9NO3
Molecular formula furigana： C10-H9-N-O3
Molecular weight： 191.186
InChI：
InChI=1S/C10H9NO3/c11-4-1-5-12-8-2-3-9-10(6-8)14-7-13-9/h2-3,6H,1,5,7H2
InChI key：
FJFNNPPPAFZQOX-UHFFFAOYSA-N
SMILES：
N#CCCOc1ccc2OCOc2c1
Systematic name (3)：
- 3-(1,3-ベンゾジオキソール-5-イルオキシ)プロピオノニトリル
- 3-(2H-1,3-ベンゾジオキソール-5-イルオキシ)プロパンニトリル
- 3-(2H-1,3-benzodioxol-5-yloxy)propanenitrile
- 3-(1,3-Benzodioxole-5-yloxy)propiononitrile
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