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CAS 913835-73-1

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3-Borono-5-bromobenzoic acid

Description:
3-Borono-5-bromobenzoic acid is an organic compound characterized by the presence of both a boronic acid group and a bromine atom attached to a benzene ring. Its molecular structure features a carboxylic acid functional group (-COOH), which contributes to its acidic properties. The boron atom in the boronic acid group (-B(OH)2) allows for potential applications in cross-coupling reactions, making it valuable in organic synthesis, particularly in the formation of carbon-carbon bonds. The bromine atom enhances its reactivity and can serve as a leaving group in various chemical reactions. This compound is typically a solid at room temperature and is soluble in polar solvents due to the presence of the carboxylic acid and boronic acid functionalities. Its applications extend to medicinal chemistry and materials science, where it can be utilized in the development of pharmaceuticals and functional materials. Safety data should be consulted for handling, as with all chemical substances, to ensure proper precautions are taken.
Formula:C7H6BBrO4
InChI:InChI=1S/C7H6BBrO4/c9-6-2-4(7(10)11)1-5(3-6)8(12)13/h1-3,12-13H,(H,10,11)
InChI key:InChIKey=CWBLIPMCDMSOFX-UHFFFAOYSA-N
SMILES:B(O)(O)C1=CC(C(O)=O)=CC(Br)=C1
Synonyms:
  • 3-Borono-5-bromobenzoic acid
  • 3-Bromo-5-(dihydroxyboranyl)benzoic acid
  • 3-Bromo-5-carboxyphenylboronic acid
  • Benzoic acid, 3-borono-5-bromo-
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