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CAS 7326-77-4

:

3-[[(Phenylmethyl)amino]sulfonyl]benzoic acid

Description:
3-[[(Phenylmethyl)amino]sulfonyl]benzoic acid, with the CAS number 7326-77-4, is an organic compound characterized by its sulfonamide functional group and a carboxylic acid moiety. This compound features a benzoic acid backbone, which is substituted at the 3-position with a sulfonamide group that is further substituted with a phenylmethyl (benzyl) amino group. The presence of the sulfonyl group contributes to its potential as a polar molecule, influencing its solubility in various solvents. The compound may exhibit acidic properties due to the carboxylic acid group, allowing it to participate in acid-base reactions. Its structure suggests potential applications in pharmaceuticals, particularly as a building block in drug synthesis or as a biologically active agent. The compound's reactivity can be attributed to the functional groups present, making it a candidate for various chemical reactions, including nucleophilic substitutions and coupling reactions. Overall, its unique structural features and functional groups provide a basis for diverse chemical behavior and potential applications in medicinal chemistry.
Formula:C14H13NO4S
InChI:InChI=1S/C14H13NO4S/c16-14(17)12-7-4-8-13(9-12)20(18,19)15-10-11-5-2-1-3-6-11/h1-9,15H,10H2,(H,16,17)
InChI key:InChIKey=IPSYRXPRMAIAKO-UHFFFAOYSA-N
SMILES:S(NCC1=CC=CC=C1)(=O)(=O)C2=CC(C(O)=O)=CC=C2
Synonyms:
  • 3-[[(Phenylmethyl)amino]sulfonyl]benzoic acid
  • Benzoic Acid, 3-[[(Phenylmethyl)Amino]Sulfonyl]-
  • Benzoic acid, m-(benzylsulfamoyl)-
  • 3-(Benzylsulfamoyl)benzoic acid
  • 3-Benzylsulfamoyl-benzoic acid
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