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CAS 874219-42-8

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B-[3-[(Cyclohexylamino)carbonyl]-5-fluorophenyl]boronic acid

Description:
B-[3-[(Cyclohexylamino)carbonyl]-5-fluorophenyl]boronic acid, with the CAS number 874219-42-8, is a boronic acid derivative characterized by its unique structural features. This compound contains a boron atom bonded to a phenyl ring that is substituted with a fluorine atom and a cyclohexylamino carbonyl group. The presence of the boronic acid functional group allows for potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, as boronic acids can act as enzyme inhibitors or in drug delivery systems. The cyclohexylamino moiety contributes to the compound's lipophilicity, which may enhance its biological activity and membrane permeability. Additionally, the fluorine atom can influence the electronic properties of the molecule, potentially affecting its reactivity and interaction with biological targets. Overall, this compound exemplifies the diverse applications of boronic acids in organic synthesis and drug development, owing to their ability to form reversible covalent bonds with diols and other nucleophiles.
Formula:C13H17BFNO3
InChI:InChI=1S/C13H17BFNO3/c15-11-7-9(6-10(8-11)14(18)19)13(17)16-12-4-2-1-3-5-12/h6-8,12,18-19H,1-5H2,(H,16,17)
InChI key:InChIKey=DYUMHPWTMLPIFV-UHFFFAOYSA-N
SMILES:C(NC1CCCCC1)(=O)C2=CC(B(O)O)=CC(F)=C2
Synonyms:
  • B-[3-[(Cyclohexylamino)carbonyl]-5-fluorophenyl]boronic acid
  • Boronic acid, B-[3-[(cyclohexylamino)carbonyl]-5-fluorophenyl]-
  • Boronic acid, [3-[(cyclohexylamino)carbonyl]-5-fluorophenyl]-
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