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CAS 79477-87-5

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3-Fluoro-α-oxobenzeneacetic acid

Description:
3-Fluoro-α-oxobenzeneacetic acid, with the CAS number 79477-87-5, is an organic compound characterized by the presence of a fluorine atom and a keto group adjacent to a carboxylic acid functional group. This compound features a benzene ring substituted at the meta position with a fluorine atom, which can influence its reactivity and interaction with biological systems. The α-oxobenzeneacetic acid structure indicates that it has both an acetic acid moiety and a ketone functional group, contributing to its potential as a versatile intermediate in organic synthesis. The presence of the fluorine atom may enhance the compound's lipophilicity and alter its pharmacokinetic properties, making it of interest in medicinal chemistry. Additionally, the compound's acidity and reactivity can be influenced by the electron-withdrawing nature of the fluorine substituent. Overall, 3-Fluoro-α-oxobenzeneacetic acid is a compound of interest for various applications, including pharmaceuticals and agrochemicals, due to its unique structural features.
Formula:C8H5FO3
InChI:InChI=1S/C8H5FO3/c9-6-3-1-2-5(4-6)7(10)8(11)12/h1-4H,(H,11,12)
InChI key:InChIKey=ZBVBBDBIFKYALY-UHFFFAOYSA-N
SMILES:C(C(O)=O)(=O)C1=CC(F)=CC=C1
Synonyms:
  • 3-Fluorophenylglyoxylic acid
  • Benzeneacetic acid, 3-fluoro-α-oxo-
  • (m-Fluorophenyl)glyoxylic acid
  • m-Fluorobenzoylformic acid
  • 3-Fluoro-α-oxobenzeneacetic acid
  • (3-fluorophenyl)(oxo)acetic acid
  • 2-(3-Fluorophenyl)-2-oxoacetic acid
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