Chem
J-GLOBAL ID:200907007335388288   Nikkaji number:J2.597.574J

2-(Trifluoromethyl)-4-nitrobenzonitrile

2-(トリフルオロメチル)-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: C8H3F3N[N+]O[O-]
Molecular formula furigana: C8-H3-F3-N2-O2
Molecular weight: 216.119
InChI: InChI=1S/C8H3F3N2O2/c9-8(10,11)7-3-6(13(14)15)2-1-5(7)4-12/h1-3H
InChI key: AGKQJEFSEQHGTA-UHFFFAOYSA-N
SMILES: [O-][N+](=O)c1ccc(C#N)c(c1)C(F)(F)F
Systematic name  (3):
  • 2-(トリフルオロメチル)-4-ニトロベンゾニトリル
  • 4-ニトロ-2-(トリフルオロメチル)ベンゾニトリル
  • 4-nitro-2-(trifluoromethyl)benzonitrile
Other name (1):
  • 2-(Trifluoromethyl)-4-nitrobenzonitrile
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