Chem
J-GLOBAL ID:200907018555215467   Nikkaji number:J929.124E

2-[3-(Trifluoromethyl)-3H-diazirin-3-yl]-4-methoxybenzoic acid

2-[3-(トリフルオロメチル)-3H-ジアジリン-3-イル]-4-メトキシ安息香酸
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: C10H7F3N2O3
Molecular formula furigana: C10-H7-F3-N2-O3
Molecular weight: 260.172
InChI: InChI=1S/C10H7F3N2O3/c1-18-5-2-3-6(8(16)17)7(4-5)9(14-15-9)10(11,12)13/h2-4H,1H3,(H,16,17)
InChI key: OCJLEILLOQGKIK-UHFFFAOYSA-N
SMILES: COc1ccc(C(=O)O)c(c1)C1(N=N1)C(F)(F)F
Systematic name  (3):
  • 2-[3-(トリフルオロメチル)-3H-ジアジリン-3-イル]-4-メトキシ安息香酸
  • 4-メトキシ-2-[3-(トリフルオロメチル)-3H-ジアジリン-3-イル]安息香酸
  • 4-methoxy-2-[3-(trifluoromethyl)-3H-diazirin-3-yl]benzoic acid
Other name (1):
  • 2-[3-(Trifluoromethyl)-3H-diazirin-3-yl]-4-methoxybenzoic acid
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