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CAS 957120-85-3

:

B-[3-Bromo-2-chloro-5-(trifluoromethyl)phenyl]boronic acid

Description:
B-[3-Bromo-2-chloro-5-(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 is widely used in organic synthesis and medicinal chemistry. The compound features a phenyl ring substituted with a bromine atom, a chlorine atom, and a trifluoromethyl group, which contribute to its unique electronic and steric properties. The trifluoromethyl group is particularly notable for enhancing lipophilicity and influencing the compound's reactivity. The presence of halogens (bromine and chlorine) can also affect the compound's stability and its interactions with biological targets. As a boronic acid, it can participate in Suzuki-Miyaura cross-coupling reactions, making it valuable in the synthesis of complex organic molecules. Additionally, the compound's solubility and reactivity can be influenced by the pH of the environment, as boronic acids can exist in different forms depending on the protonation state. Overall, this compound is significant in both synthetic and pharmaceutical chemistry.
Formula:C7H4BBrClF3O2
InChI:InChI=1S/C7H4BBrClF3O2/c9-5-2-3(7(11,12)13)1-4(6(5)10)8(14)15/h1-2,14-15H
InChI key:InChIKey=DBIZIJSYGAIRIZ-UHFFFAOYSA-N
SMILES:B(O)(O)C1=CC(C(F)(F)F)=CC(Br)=C1Cl
Synonyms:
  • 3-Bromo-2-Chloro-5-(Trifluoromethyl)Phenylboronic Acid
  • B-[3-Bromo-2-chloro-5-(trifluoromethyl)phenyl]boronic acid
  • Boronic acid, B-[3-bromo-2-chloro-5-(trifluoromethyl)phenyl]-
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