Chem
J-GLOBAL ID：200907079799906355
Nikkaji number：J524.685G
4-Fluoro-3-(trifluoromethyl)benzoic acid
4-フルオロ-3-(トリフルオロメチル)安息香酸
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
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
Molecular formula： C8H4F4O2
Molecular formula furigana： C8-H4-F4-O2
Molecular weight： 208.112
InChI：
InChI=1S/C8H4F4O2/c9-6-2-1-4(7(13)14)3-5(6)8(10,11)12/h1-3H,(H,13,14)
InChI key：
WZBPZYCJUADXRS-UHFFFAOYSA-N
SMILES：
OC(=O)c1ccc(F)c(c1)C(F)(F)F
Systematic name (2)：
- 4-フルオロ-3-(トリフルオロメチル)安息香酸
- 4-fluoro-3-(trifluoromethyl)benzoic acid
- 4-Fluoro-3-(trifluoromethyl)benzoic acid
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