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CAS 871329-85-0

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Benzoic acid, 3-borono-5-fluoro-, 1-ethyl ester

Description:
Benzoic acid, 3-borono-5-fluoro-, 1-ethyl ester is an organic compound characterized by its functional groups, which include a benzoic acid moiety, a boron atom, and a fluorine atom. The presence of the boron group suggests potential applications in medicinal chemistry and materials science, particularly in the development of boron-containing compounds for drug delivery or as catalysts. The ethyl ester group indicates that this compound is likely to be more lipophilic, which can influence its solubility and reactivity. The fluorine atom can enhance the compound's biological activity and stability, making it of interest in pharmaceutical applications. Additionally, the specific positioning of the boron and fluorine substituents on the aromatic ring can affect the compound's electronic properties and reactivity. Overall, this compound exemplifies the intersection of organic chemistry and functional group manipulation, leading to potential applications in various fields, including drug design and synthesis.
Formula:C9H10BFO4
InChI:InChI=1S/C9H10BFO4/c1-2-15-9(12)6-3-7(10(13)14)5-8(11)4-6/h3-5,13-14H,2H2,1H3
InChI key:InChIKey=HJLWJMNBGUVWFR-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C1=CC(B(O)O)=CC(F)=C1
Synonyms:
  • Benzoic acid, 3-borono-5-fluoro-, 1-ethyl ester
  • (3-(Ethoxycarbonyl)-5-fluorophenyl)boronicacid
  • 3-Fluoro-5-ethoxycarbonylphenylboronic acid
  • [3-(Ethoxycarbonyl)-5-fluorophenyl]boronic acid
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