Chem
J-GLOBAL ID：201707008608822988   Nikkaji number：J3.633.599H

1-(Pentafluoroethyl)-3-nitrobenzene

1-(ペンタフルオロエチル)-3-ニトロベンゼン
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： C8H4F5[N+]O[O-]
Molecular formula furigana： C8-H4-F5-N-O2
Molecular weight： 241.117
InChI： InChI=1S/C8H4F5NO2/c9-7(10,8(11,12)13)5-2-1-3-6(4-5)14(15)16/h1-4H
InChI key： PTNKXRHFXJJVLK-UHFFFAOYSA-N
SMILES： [O-][N+](=O)c1cccc(c1)C(F)(F)C(F)(F)F
Systematic name  (3)：
  • 1-(ペンタフルオロエチル)-3-ニトロベンゼン
  • 1-ニトロ-3-(1,1,2,2,2-ペンタフルオロエチル)ベンゼン
  • 1-nitro-3-(1,1,2,2,2-pentafluoroethyl)benzene
Other name (1)：
  • 1-(Pentafluoroethyl)-3-nitrobenzene
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