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CAS 331-55-5

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2-[(3-Fluorophenyl)thio]acetic acid

Description:
2-[(3-Fluorophenyl)thio]acetic acid, with the CAS number 331-55-5, is an organic compound characterized by the presence of a thiol group (-S-) linked to a 3-fluorophenyl group and an acetic acid moiety. This compound typically appears as a white to off-white solid and is soluble in polar solvents due to the presence of the carboxylic acid functional group. The fluorine atom on the phenyl ring can influence the compound's electronic properties, potentially enhancing its reactivity and biological activity. The thiol group may also impart unique characteristics, such as the ability to form disulfide bonds or participate in nucleophilic reactions. This compound is of interest in various fields, including medicinal chemistry and materials science, due to its potential applications in drug development and as a building block for more complex molecules. Safety data should be consulted for handling and storage, as with any chemical substance, to ensure proper precautions are taken.
Formula:C8H7FO2S
InChI:InChI=1S/C8H7FO2S/c9-6-2-1-3-7(4-6)12-5-8(10)11/h1-4H,5H2,(H,10,11)
InChI key:InChIKey=JDPSVGKEJKYOAZ-UHFFFAOYSA-N
SMILES:S(CC(O)=O)C1=CC(F)=CC=C1
Synonyms:
  • Acetic acid, [(3-fluorophenyl)thio]-
  • Acetic acid, 2-[(3-fluorophenyl)thio]-
  • (3-Fluorophenylsulfanyl)acetic acid
  • 2-[(3-Fluorophenyl)thio]acetic acid
  • Acetic acid, [(m-fluorophenyl)thio]-
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