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CAS 887267-03-0

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3,6-Difluoro-2-methoxybenzoic acid

Description:
3,6-Difluoro-2-methoxybenzoic acid is an aromatic carboxylic acid characterized by the presence of two fluorine atoms and a methoxy group on a benzoic acid framework. The molecular structure features a benzene ring substituted at the 2-position with a methoxy group (-OCH3) and at the 3- and 6-positions with fluorine atoms (F). This compound is typically a white to off-white solid and is soluble in organic solvents, with limited solubility in water due to its hydrophobic aromatic structure. The presence of fluorine atoms enhances its lipophilicity and may influence its biological activity, making it of interest in pharmaceutical research. The carboxylic acid functional group (-COOH) contributes to its acidity and reactivity, allowing for potential applications in organic synthesis and medicinal chemistry. Additionally, the compound's unique substitution pattern may impart specific electronic and steric properties, which can be crucial for its interactions in various chemical environments.
Formula:C8H6F2O3
InChI:InChI=1S/C8H6F2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)
InChI key:InChIKey=LFXJCALGZMNDHA-UHFFFAOYSA-N
SMILES:C(O)(=O)C1=C(OC)C(F)=CC=C1F
Synonyms:
  • Benzoic acid, 3,6-difluoro-2-methoxy-
  • 3,6-Difluoro-2-methoxybenzoic acid
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