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CAS 874289-53-9

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B-[2-Fluoro-5-[[(phenylmethyl)amino]carbonyl]phenyl]boronic acid

Description:
B-[2-Fluoro-5-[[(phenylmethyl)amino]carbonyl]phenyl]boronic acid is a boronic acid derivative characterized by its unique molecular structure, which includes a boron atom bonded to a phenyl group and an amino carbonyl substituent. This compound features a fluorine atom at the ortho position relative to the boronic acid group, enhancing its reactivity and potential applications in medicinal chemistry. Boronic acids are known for their ability to form reversible covalent bonds with diols, making them valuable in various chemical reactions, including Suzuki coupling, which is widely used in organic synthesis. The presence of the phenylmethylamino group suggests potential biological activity, as such moieties are often found in pharmaceuticals. Additionally, the compound's solubility and stability in aqueous environments can be influenced by the boronic acid functionality, which may also participate in interactions with biological targets. Overall, this compound's structural features position it as a candidate for further research in drug development and synthetic chemistry.
Formula:C14H13BFNO3
InChI:InChI=1S/C14H13BFNO3/c16-13-7-6-11(8-12(13)15(19)20)14(18)17-9-10-4-2-1-3-5-10/h1-8,19-20H,9H2,(H,17,18)
InChI key:InChIKey=REOKRXJQZIVZIB-UHFFFAOYSA-N
SMILES:C(NCC1=CC=CC=C1)(=O)C2=CC(B(O)O)=C(F)C=C2
Synonyms:
  • B-[2-Fluoro-5-[[(phenylmethyl)amino]carbonyl]phenyl]boronic acid
  • [5-(Benzylcarbamoyl)-2-fluorophenyl]boronic acid
  • Boronic acid, B-[2-fluoro-5-[[(phenylmethyl)amino]carbonyl]phenyl]-
  • Boronic acid, [2-fluoro-5-[[(phenylmethyl)amino]carbonyl]phenyl]-
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