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CAS 39058-84-9

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3-bromo-4-methylsulfonyl-benzoic acid

Description:
3-Bromo-4-methylsulfonyl-benzoic acid is an aromatic compound characterized by the presence of a bromine atom and a methylsulfonyl group attached to a benzoic acid structure. Its molecular formula typically includes a benzene ring substituted with a carboxylic acid group (-COOH), a bromine atom at the 3-position, and a methylsulfonyl group (-SO2CH3) at the 4-position. This compound is likely to exhibit moderate solubility in polar solvents due to the presence of the carboxylic acid group, while the bromine and sulfonyl groups may influence its reactivity and polarity. It may participate in various chemical reactions, including nucleophilic substitutions and electrophilic aromatic substitutions, due to the electron-withdrawing nature of the bromine and sulfonyl groups. Additionally, the compound may have applications in pharmaceuticals or agrochemicals, given the functional groups that can enhance biological activity. Safety data should be consulted for handling, as with any chemical substance, to ensure proper precautions are taken.
Formula:C8H7BrO4S
InChI:InChI=1/C8H7BrO4S/c1-14(12,13)7-3-2-5(8(10)11)4-6(7)9/h2-4H,1H3,(H,10,11)
SMILES:CS(=O)(=O)c1ccc(cc1Br)C(=O)O
Synonyms:
  • Benzoic acid, 3-bromo-4-(methylsulfonyl)-
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