Chem
J-GLOBAL ID:200907004101204400   Nikkaji number:J267.485H

3-Methyl-4-nitrobenzonitrile

3-メチル-4-ニトロベンゾニトリル
Substance type:
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
Molecular formula: C8H6N[N+]O[O-]
Molecular formula furigana: C8-H6-N2-O2
Molecular weight: 162.148
InChI: InChI=1S/C8H6N2O2/c1-6-4-7(5-9)2-3-8(6)10(11)12/h2-4H,1H3
InChI key: IHVNKSXTJZNBQA-UHFFFAOYSA-N
SMILES: Cc1cc(ccc1[N+](=O)[O-])C#N
Systematic name  (2):
  • 3-メチル-4-ニトロベンゾニトリル
  • 3-methyl-4-nitrobenzonitrile
Other name (1):
  • 3-Methyl-4-nitrobenzonitrile
CAS registry number: 96784-54-2
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