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CAS 4837-22-3

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4-[(difluoromethyl)sulfonyl]benzoic acid

Description:
4-[(Difluoromethyl)sulfonyl]benzoic acid, with the CAS number 4837-22-3, is an organic compound characterized by the presence of a benzoic acid moiety substituted with a difluoromethylsulfonyl group. This compound typically exhibits a white to off-white crystalline appearance. It is known for its sulfonyl functional group, which contributes to its reactivity and potential applications in various chemical reactions, particularly in the synthesis of pharmaceuticals and agrochemicals. The difluoromethyl group enhances its lipophilicity and may influence its biological activity. In terms of solubility, it is generally soluble in polar organic solvents, while its solubility in water may be limited due to the hydrophobic nature of the aromatic ring. The compound's properties, such as melting point and boiling point, can vary based on purity and specific conditions. Safety data should be consulted for handling, as it may pose health risks if ingested or inhaled. Overall, 4-[(difluoromethyl)sulfonyl]benzoic acid is a valuable compound in synthetic organic chemistry.
Formula:C8H6F2O4S
InChI:InChI=1/C8H6F2O4S/c9-8(10)15(13,14)6-3-1-5(2-4-6)7(11)12/h1-4,8H,(H,11,12)
SMILES:c1cc(ccc1C(=O)O)S(=O)(=O)C(F)F
Synonyms:
  • Benzoic Acid, 4-[(Difluoromethyl)Sulfonyl]-
  • 4-[(Difluoromethyl)Sulfonyl]Benzoate
  • 4-[(Difluoromethyl)sulfonyl]benzoic acid
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