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CAS 886498-89-1

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3-fluoro-4-(trifluoromethoxy)benzoic acid

Description:
3-Fluoro-4-(trifluoromethoxy)benzoic acid is an aromatic carboxylic acid characterized by the presence of a fluorine atom and a trifluoromethoxy group attached to a benzoic acid framework. The molecular structure features a benzene ring with a carboxylic acid (-COOH) functional group, which contributes to its acidic properties. The trifluoromethoxy group (-O-CF3) enhances the compound's lipophilicity and can influence its reactivity and solubility in organic solvents. This compound is likely to exhibit strong hydrogen bonding due to the carboxylic acid group, while the presence of multiple fluorine atoms can impart unique electronic properties, making it of interest in various chemical applications, including pharmaceuticals and agrochemicals. Additionally, the fluorinated groups can enhance metabolic stability and alter the pharmacokinetic properties of potential drug candidates. Overall, 3-fluoro-4-(trifluoromethoxy)benzoic acid is a compound with distinctive characteristics that may be leveraged in synthetic chemistry and material science.
Formula:C8H4F4O3
InChI:InChI=1/C8H4F4O3/c9-5-3-4(7(13)14)1-2-6(5)15-8(10,11)12/h1-3H,(H,13,14)
SMILES:c1cc(c(cc1C(=O)O)F)OC(F)(F)F
Synonyms:
  • Benzoic Acid, 3-Fluoro-4-(Trifluoromethoxy)-
  • Qvr Cf Doxfff
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