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CAS 2096342-15-1

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Boronic acid, B-[3-bromo-2-fluoro-5-(trifluoromethoxy)phenyl]-

Description:
Boronic acids are a class of organic compounds characterized by the presence of a boron atom bonded to a hydroxyl group and an organic substituent. The specific compound "Boronic acid, B-[3-bromo-2-fluoro-5-(trifluoromethoxy)phenyl]-" features a phenyl ring with multiple substituents, including a bromine atom, a fluorine atom, and a trifluoromethoxy group, which significantly influence its chemical properties. This compound is likely to exhibit moderate to high reactivity due to the presence of the boron atom, which can form coordinate bonds with various nucleophiles. The trifluoromethoxy group enhances its lipophilicity and may affect its solubility in organic solvents. Additionally, the presence of halogens (bromine and fluorine) can impart unique electronic properties, making it useful in various applications, including medicinal chemistry and materials science. The compound's structure suggests potential utility in cross-coupling reactions, a common method in organic synthesis for forming carbon-carbon bonds. Overall, its unique substituents and boronic acid functionality make it a valuable compound in synthetic organic chemistry.
Formula:C7H4BBrF4O3
InChI:InChI=1S/C7H4BBrF4O3/c9-5-2-3(16-7(11,12)13)1-4(6(5)10)8(14)15/h1-2,14-15H
InChI key:InChIKey=IPONDPCBQLMVCI-UHFFFAOYSA-N
SMILES:O(C(F)(F)F)C1=CC(B(O)O)=C(F)C(Br)=C1
Synonyms:
  • Boronic acid, B-[3-bromo-2-fluoro-5-(trifluoromethoxy)phenyl]-
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