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CAS 1214386-42-1

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3-(Difluoromethoxy)-5-fluorobenzoic acid

Description:
3-(Difluoromethoxy)-5-fluorobenzoic acid is a chemical compound characterized by its unique structure, which includes a benzoic acid moiety substituted with both difluoromethoxy and fluorine groups. The presence of the difluoromethoxy group introduces significant electronegativity, influencing the compound's reactivity and solubility. The fluorine atoms enhance the compound's lipophilicity, making it potentially useful in pharmaceutical applications. This compound is likely to exhibit acidic properties due to the carboxylic acid functional group, which can donate protons in solution. Additionally, the presence of multiple fluorine atoms may contribute to its stability and resistance to metabolic degradation. The compound's molecular interactions can be influenced by hydrogen bonding and dipole-dipole interactions, which are critical in determining its behavior in biological systems. Overall, 3-(Difluoromethoxy)-5-fluorobenzoic acid is of interest in medicinal chemistry and materials science due to its unique electronic properties and potential applications in drug development.
Formula:C8H5F3O3
InChI:InChI=1S/C8H5F3O3/c9-5-1-4(7(12)13)2-6(3-5)14-8(10)11/h1-3,8H,(H,12,13)
InChI key:InChIKey=IAUOGCKRYWZGMC-UHFFFAOYSA-N
SMILES:O(C(F)F)C1=CC(C(O)=O)=CC(F)=C1
Synonyms:
  • Benzoic acid, 3-(difluoromethoxy)-5-fluoro-
  • 3-(Difluoromethoxy)-5-fluorobenzoic acid
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