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CAS 913835-93-5

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Benzoic acid, 3-borono-4-chloro-, 1-ethyl ester

Description:
Benzoic acid, 3-borono-4-chloro-, 1-ethyl ester is an organic compound characterized by its functional groups, which include a benzoic acid moiety, a boron atom, and a chloro substituent. The presence of the boron atom suggests potential applications in organic synthesis and materials science, particularly in the formation of boron-containing compounds. The chloro group indicates that the compound may exhibit reactivity typical of halogenated compounds, potentially participating in nucleophilic substitution reactions. The ethyl ester functionality implies that it can undergo hydrolysis to yield the corresponding benzoic acid, which is known for its antimicrobial properties. This compound may also be of interest in medicinal chemistry and agrochemicals due to its structural features. Its CAS number, 913835-93-5, allows for precise identification in chemical databases. Overall, the unique combination of functional groups in this compound may lead to diverse applications in various fields, including pharmaceuticals and materials development.
Formula:C9H10BClO4
InChI:InChI=1S/C9H10BClO4/c1-2-15-9(12)6-3-4-8(11)7(5-6)10(13)14/h3-5,13-14H,2H2,1H3
InChI key:InChIKey=MWOJXHPAEOGJPL-UHFFFAOYSA-N
SMILES:B(O)(O)C1=CC(C(OCC)=O)=CC=C1Cl
Synonyms:
  • (2-Chloro-5-(ethoxycarbonyl)phenyl)boronicacid
  • (2-Chloro-5-ethoxycarbonylphenyl)boronic acid
  • 2-Chloro-5-(ethoxycarbonyl)benzeneboronic acid
  • Benzoic acid, 3-borono-4-chloro-, 1-ethyl ester
  • [2-Chloro-5-(ethoxycarbonyl)phenyl]boronic acid
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