Chem
J-GLOBAL ID：200907039355413709   Nikkaji number：J47.813J

4-Nitrobenzonitrile

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： C7H4N[N+]O[O-]
Molecular formula furigana： C7-H4-N2-O2
Molecular weight： 148.121
InChI： InChI=1S/C7H4N2O2/c8-5-6-1-3-7(4-2-6)9(10)11/h1-4H
InChI key： NKJIFDNZPGLLSH-UHFFFAOYSA-N
SMILES： [O-][N+](=O)c1ccc(cc1)C#N
Systematic name  (6)：
  • 4-シアノ-1-ニトロベンゼン
  • 1-ニトロ-4-シアノベンゼン
  • 1-シアノ-4-ニトロベンゼン
  • 4-ニトロベンゾニトリル
  • p-ニトロベンゾニトリル
Show all
Other name (6)：
  • 4-Nitrobenzonitrile
  • p-Nitrobenzonitrile
  • 4-Nitrobenzenecarbonitrile
  • 4-Cyano-1-nitrobenzene
  • 1-Nitro-4-cyanobenzene
Show all
CAS registry number： 619-72-7
Regulation number (4)：
  • (3)-1782
  • DI4903500
  • EINECS2106100
  • TSCA(619-72-7)
Thsaurus map：
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