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CAS 874289-19-7

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B-[3-Fluoro-4-[[(phenylmethyl)amino]carbonyl]phenyl]boronic acid

Description:
B-[3-Fluoro-4-[[(phenylmethyl)amino]carbonyl]phenyl]boronic acid is a boronic acid derivative characterized by its unique functional groups, which include a boron atom bonded to a phenyl ring and an amide group. This compound features a fluorine atom at the para position relative to the boronic acid moiety, which can influence its reactivity and interaction with biological targets. The presence of the phenylmethylamino group suggests potential applications in medicinal chemistry, particularly in the development of inhibitors or modulators of biological pathways. Boronic acids are known for their ability to form reversible covalent bonds with diols, making them useful in various applications, including drug design and materials science. Additionally, the compound's structure may confer specific solubility and stability characteristics, which are critical for its performance in biological systems. Overall, B-[3-Fluoro-4-[[(phenylmethyl)amino]carbonyl]phenyl]boronic acid represents a versatile scaffold for further chemical exploration and potential therapeutic applications.
Formula:C14H13BFNO3
InChI:InChI=1S/C14H13BFNO3/c16-13-8-11(15(19)20)6-7-12(13)14(18)17-9-10-4-2-1-3-5-10/h1-8,19-20H,9H2,(H,17,18)
InChI key:InChIKey=XTSLGOGQMXSTRK-UHFFFAOYSA-N
SMILES:C(NCC1=CC=CC=C1)(=O)C2=C(F)C=C(B(O)O)C=C2
Synonyms:
  • Boronic acid, B-[3-fluoro-4-[[(phenylmethyl)amino]carbonyl]phenyl]-
  • Boronic acid, [3-fluoro-4-[[(phenylmethyl)amino]carbonyl]phenyl]-
  • B-[3-Fluoro-4-[[(phenylmethyl)amino]carbonyl]phenyl]boronic acid
  • 4-(Benzylcarbamoyl)-3-fluorophenylboronic acid
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