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CAS 3405-89-8

:

(4-Chlorophenylsulfonyl)acetic acid

Description:
(4-Chlorophenylsulfonyl)acetic acid, with the CAS number 3405-89-8, is an organic compound characterized by the presence of a chlorophenyl group and a sulfonyl functional group attached to an acetic acid moiety. This compound typically appears as a white to off-white solid and is soluble in polar solvents such as water and alcohols, owing to its carboxylic acid functionality. The presence of the sulfonyl group enhances its reactivity, making it useful in various chemical syntheses and applications, particularly in medicinal chemistry as a potential intermediate in drug development. The chlorophenyl substituent can influence the compound's biological activity and lipophilicity, affecting its pharmacokinetic properties. Additionally, (4-Chlorophenylsulfonyl)acetic acid may exhibit properties such as acidity, which can be measured by its pKa value, and it may participate in various chemical reactions, including nucleophilic substitutions and coupling reactions. Safety data should be consulted for handling and storage, as with any chemical substance.
Formula:C8H6ClO4S
InChI:InChI=1/C8H7ClO4S/c9-6-1-3-7(4-2-6)14(12,13)5-8(10)11/h1-4H,5H2,(H,10,11)/p-1
SMILES:c1cc(ccc1Cl)S(=O)(=O)CC(=O)[O-]
Synonyms:
  • [(4-Chlorophenyl)sulfonyl]acetic acid
  • 3405-89-8
  • Acetic acid, 2-[(4-chlorophenyl)sulfonyl]-
  • [(4-Chlorophenyl)Sulfonyl]Acetate
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