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CAS 120658-70-0

:

α-Oxo-3-(trifluoromethyl)benzenepropanoic acid

Description:
α-Oxo-3-(trifluoromethyl)benzenepropanoic acid, with the CAS number 120658-70-0, is an organic compound characterized by its unique functional groups and structural features. It contains a benzene ring substituted with a trifluoromethyl group, which significantly influences its chemical reactivity and physical properties. The presence of the α-oxo group indicates that it has a carbonyl functionality adjacent to a carboxylic acid, contributing to its acidity and potential for various chemical reactions, such as condensation and esterification. This compound is likely to exhibit moderate solubility in polar solvents due to the carboxylic acid group, while the trifluoromethyl group may enhance its lipophilicity. Its trifluoromethyl substituent can also impart unique electronic properties, making it of interest in medicinal chemistry and materials science. Overall, α-Oxo-3-(trifluoromethyl)benzenepropanoic acid is a versatile compound with potential applications in pharmaceuticals and agrochemicals, owing to its distinctive chemical structure and properties.
Formula:C10H7F3O3
InChI:InChI=1S/C10H7F3O3/c11-10(12,13)7-3-1-2-6(4-7)5-8(14)9(15)16/h1-4H,5H2,(H,15,16)
InChI key:InChIKey=AGRTZGDRXOCMEU-UHFFFAOYSA-N
SMILES:C(C(C(O)=O)=O)C1=CC(C(F)(F)F)=CC=C1
Synonyms:
  • α-Oxo-3-(trifluoromethyl)benzenepropanoic acid
  • Benzenepropanoic acid, α-oxo-3-(trifluoromethyl)-
  • 2-Oxo-3-[3-(trifluoromethyl)phenyl]propanoic acid
  • 2-Oxo-3-(3-trifluoromethylphenyl)propionic acid
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