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CAS 2121513-80-0

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B-[5-Chloro-2-fluoro-3-(trifluoromethyl)phenyl]boronic acid

Description:
B-[5-Chloro-2-fluoro-3-(trifluoromethyl)phenyl]boronic acid is an organoboron compound characterized by the presence of a boronic acid functional group, which is known for its ability to form reversible covalent bonds with diols and other nucleophiles. This compound features a phenyl ring substituted with a chlorine atom, a fluorine atom, and a trifluoromethyl group, contributing to its unique electronic properties and potential reactivity. The trifluoromethyl group is particularly notable for enhancing lipophilicity and influencing the compound's biological activity. Boronic acids are often utilized in organic synthesis, particularly in Suzuki coupling reactions, which are valuable for forming carbon-carbon bonds. Additionally, the presence of halogen substituents can affect the compound's solubility, stability, and interaction with biological targets. Overall, B-[5-Chloro-2-fluoro-3-(trifluoromethyl)phenyl]boronic acid is a versatile compound with applications in medicinal chemistry and materials science, particularly in the development of pharmaceuticals and agrochemicals.
Formula:C7H4BClF4O2
InChI:InChI=1S/C7H4BClF4O2/c9-3-1-4(7(11,12)13)6(10)5(2-3)8(14)15/h1-2,14-15H
InChI key:InChIKey=YLUJXEGLBJMSAT-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=C(F)C(B(O)O)=CC(Cl)=C1
Synonyms:
  • Boronic acid, B-[5-chloro-2-fluoro-3-(trifluoromethyl)phenyl]-
  • B-[5-Chloro-2-fluoro-3-(trifluoromethyl)phenyl]boronic acid
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