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CAS 1072946-64-5

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B-[5-Cyano-2-(trifluoromethoxy)phenyl]boronic acid

Description:
B-[5-Cyano-2-(trifluoromethoxy)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, making it useful in various applications, including organic synthesis and medicinal chemistry. The compound features a cyano group, which contributes to its electronic properties and can enhance its reactivity. The trifluoromethoxy group introduces significant electronegativity, influencing the compound's polarity and solubility in organic solvents. This compound is typically a solid at room temperature and may exhibit moderate stability under standard conditions, although it can be sensitive to moisture due to the boronic acid moiety. Its unique structural features make it a valuable intermediate in the synthesis of pharmaceuticals and agrochemicals, as well as a potential ligand in coordination chemistry. Safety precautions should be taken when handling this compound, as boronic acids can be irritants and may pose environmental hazards.
Formula:C8H5BF3NO3
InChI:InChI=1S/C8H5BF3NO3/c10-8(11,12)16-7-2-1-5(4-13)3-6(7)9(14)15/h1-3,14-15H
InChI key:InChIKey=SZPKBNMEIASWNB-UHFFFAOYSA-N
SMILES:B(O)(O)C1=C(OC(F)(F)F)C=CC(C#N)=C1
Synonyms:
  • B-[5-Cyano-2-(trifluoromethoxy)phenyl]boronic acid
  • Boronic acid, B-[5-cyano-2-(trifluoromethoxy)phenyl]-
  • 5-Cyano-2-(trifluoromethoxy)phenylboronic acid
  • 5-Cyano-2-(trifluoroMethoxy)benzeneboronic acid, 97%
  • 5-Cyano-2-(trifluoromethoxy)phenylboronic acid（contains varying amounts of Anhydride）
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