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CAS 890097-97-9

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4-Fluoro-3-methyl-α-oxobenzeneacetic acid

Description:
4-Fluoro-3-methyl-α-oxobenzeneacetic acid, identified by its CAS number 890097-97-9, is an organic compound characterized by the presence of a fluorine atom, a methyl group, and an α-oxobenzeneacetic acid structure. This compound features a benzene ring substituted with a fluorine atom at the para position and a methyl group at the meta position relative to the carboxylic acid group. The α-oxo functional group contributes to its reactivity, making it a potential candidate for various chemical reactions, including acylation and condensation. The presence of the carboxylic acid group indicates that it can participate in acid-base reactions and may exhibit solubility in polar solvents. Additionally, the fluorine atom can influence the compound's electronic properties, potentially enhancing its biological activity or altering its interaction with other molecules. Overall, 4-Fluoro-3-methyl-α-oxobenzeneacetic acid is of interest in medicinal chemistry and materials science due to its unique structural features and potential applications.
Formula:C9H7FO3
InChI:InChI=1S/C9H7FO3/c1-5-4-6(2-3-7(5)10)8(11)9(12)13/h2-4H,1H3,(H,12,13)
InChI key:InChIKey=RECCTONTBJBQKM-UHFFFAOYSA-N
SMILES:C(C(O)=O)(=O)C1=CC(C)=C(F)C=C1
Synonyms:
  • Benzeneacetic acid, 4-fluoro-3-methyl-α-oxo-
  • 4-Fluoro-3-methyl-α-oxobenzeneacetic acid
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