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CAS 261951-80-8

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3-Fluoro-2-(trifluoromethyl)benzoic acid

Description:
3-Fluoro-2-(trifluoromethyl)benzoic acid is an aromatic carboxylic acid characterized by the presence of a fluorine atom and a trifluoromethyl group attached to a benzene ring. The molecular structure features a benzoic acid moiety, which contributes to its acidic properties, while the trifluoromethyl group enhances its lipophilicity and can influence its reactivity and interaction with biological systems. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its unique fluorinated structure can impart distinctive chemical properties, such as increased stability and altered reactivity compared to non-fluorinated analogs. Additionally, the presence of fluorine atoms can enhance the compound's potential applications in pharmaceuticals and agrochemicals, as fluorinated compounds often exhibit improved metabolic stability and bioactivity. Safety data should be consulted for handling and usage, as fluorinated compounds can pose specific health and environmental risks.
Formula:C8H4F4O2
InChI:InChI=1S/C8H4F4O2/c9-5-3-1-2-4(7(13)14)6(5)8(10,11)12/h1-3H,(H,13,14)
InChI key:InChIKey=CDGGKKODENBDJO-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=C(C(O)=O)C=CC=C1F
Synonyms:
  • 3-Fluoro-2-Trifluoromethylbenzoic Acid
  • Benzoic acid, 3-fluoro-2-(trifluoromethyl)-
  • Qvr Cf Bxfff
  • alpha,alpha,alpha,3,Tetrafluoro-o-toluic acid
  • 3-Fluoro-2-(trifluoromethyl)benzoic acid
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