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CAS 845781-44-4

:

3,5-Difluoro-β-methyl-δ-oxobenzenepentanoic acid

Description:
3,5-Difluoro-β-methyl-δ-oxobenzenepentanoic acid, identified by its CAS number 845781-44-4, is a synthetic organic compound characterized by its unique molecular structure, which includes a pentanoic acid backbone with a β-methyl group and two fluorine atoms positioned at the 3 and 5 positions of a benzene ring. This compound exhibits properties typical of both carboxylic acids and aromatic compounds, including potential acidity due to the carboxylic acid functional group and hydrophobic characteristics from the aromatic ring. The presence of fluorine atoms can enhance the compound's lipophilicity and influence its reactivity, making it of interest in various chemical applications, including pharmaceuticals and agrochemicals. Additionally, the compound's structural features may contribute to its biological activity, potentially affecting its interaction with biological targets. Overall, 3,5-Difluoro-β-methyl-δ-oxobenzenepentanoic acid represents a complex molecule with diverse chemical properties and potential applications in research and industry.
Formula:C12H12F2O3
InChI:InChI=1S/C12H12F2O3/c1-7(3-12(16)17)2-11(15)8-4-9(13)6-10(14)5-8/h4-7H,2-3H2,1H3,(H,16,17)
InChI key:InChIKey=CLNJUIWHVAHCGO-UHFFFAOYSA-N
SMILES:C(CC(CC(O)=O)C)(=O)C1=CC(F)=CC(F)=C1
Synonyms:
  • 3,5-Difluoro-β-methyl-δ-oxobenzenepentanoic acid
  • Benzenepentanoic acid, 3,5-difluoro-β-methyl-δ-oxo-
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