Chem
J-GLOBAL ID:200907096983916918   Nikkaji number:J130.643J

(Nitromethyl)benzene

(ニトロメチル)ベンゼン
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: C7H7[N+]O[O-]
Molecular formula furigana: C7-H7-N-O2
Molecular weight: 137.138
InChI: InChI=1S/C7H7NO2/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2
InChI key: VLZLOWPYUQHHCG-UHFFFAOYSA-N
SMILES: [O-][N+](=O)Cc1ccccc1
Systematic name  (8):
  • ニトロフェニルメタン
  • フェニルニトロメタン
  • ニトロ(フェニル)メタン
  • α-ニトロトルエン
  • (ニトロメチル)ベンゼン
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Other name (7):
  • α-Nitrotoluene
  • (Nitromethyl)benzene
  • Nitromethylbenzene
  • 1-(Nitromethyl)benzene
  • Nitrophenylmethane
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CAS registry number: 622-42-4
Regulation number (1):
  • (3)-437
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