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CAS 129931-45-9

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3-Chloro-2-fluoro-5-(trifluoromethyl)benzoic acid

Description:
3-Chloro-2-fluoro-5-(trifluoromethyl)benzoic acid is an aromatic carboxylic acid characterized by the presence of multiple halogen substituents on its benzene ring. The compound features a chloro group at the meta position, a fluoro group at the ortho position, and a trifluoromethyl group at the para position relative to the carboxylic acid functional group. This unique arrangement of substituents contributes to its chemical reactivity and physical properties, such as increased acidity compared to non-halogenated benzoic acids. The presence of electronegative halogens enhances the compound's ability to participate in various chemical reactions, including nucleophilic substitutions and electrophilic aromatic substitutions. Additionally, the trifluoromethyl group is known for imparting lipophilicity, which can influence the compound's solubility and biological activity. Overall, 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoic acid is of interest in fields such as medicinal chemistry and agrochemicals, where halogenated compounds often exhibit unique properties and activities.
Formula:C8H2ClF4O2
InChI:InChI=1/C8H3ClF4O2/c9-5-2-3(8(11,12)13)1-4(6(5)10)7(14)15/h1-2H,(H,14,15)/p-1
SMILES:c1c(cc(c(c1C(=O)[O-])F)Cl)C(F)(F)F
Synonyms:
  • 3-Chloro-2-Fluoro-5-(Trifluoromethyl)Benzoate
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