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CAS 886569-97-7

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3-[(4-Fluorophenyl)methyl]benzoic acid

Description:
3-[(4-Fluorophenyl)methyl]benzoic acid, identified by its CAS number 886569-97-7, is an aromatic carboxylic acid characterized by the presence of a benzoic acid moiety substituted with a 4-fluorobenzyl group at the meta position. This compound typically exhibits a solid state at room temperature and is soluble in organic solvents, reflecting its hydrophobic aromatic structure. The presence of the fluorine atom enhances its lipophilicity and may influence its biological activity, making it of interest in medicinal chemistry. The carboxylic acid functional group contributes to its acidity and potential reactivity, allowing for various chemical transformations. Additionally, the compound may exhibit specific interactions with biological targets, which can be explored in drug design and development. Its structural features suggest potential applications in pharmaceuticals, particularly in the development of anti-inflammatory or analgesic agents. Overall, 3-[(4-Fluorophenyl)methyl]benzoic acid is a compound of interest due to its unique structural characteristics and potential utility in various chemical and biological contexts.
Formula:C14H11FO2
InChI:InChI=1S/C14H11FO2/c15-13-6-4-10(5-7-13)8-11-2-1-3-12(9-11)14(16)17/h1-7,9H,8H2,(H,16,17)
InChI key:InChIKey=IQZZTFXFBHYWOL-UHFFFAOYSA-N
SMILES:C(C1=CC(C(O)=O)=CC=C1)C2=CC=C(F)C=C2
Synonyms:
  • Benzoic acid, 3-[(4-fluorophenyl)methyl]-
  • 3-[(4-Fluorophenyl)methyl]benzoic acid
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