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CAS 957120-26-2

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Benzoic acid,3-borono-5-chloro-, 1-methyl ester

Description:
Benzoic acid, 3-borono-5-chloro-, 1-methyl ester, identified by CAS number 957120-26-2, is an organic compound characterized by the presence of a benzoic acid moiety modified with a boron group and a chlorine atom. This compound features a methyl ester functional group, which enhances its solubility in organic solvents and may influence its reactivity. The boron atom introduces unique properties, potentially facilitating coordination with other molecules or acting as a catalyst in various chemical reactions. The chlorine substituent can affect the compound's electronic properties and reactivity, making it useful in synthetic organic chemistry. Typically, such compounds are of interest in medicinal chemistry and materials science due to their potential applications in drug development and as intermediates in the synthesis of more complex molecules. The presence of these functional groups suggests that the compound may exhibit interesting biological activities or serve as a building block for further chemical modifications.
Formula:C8H8BClO4
InChI:InChI=1S/C8H8BClO4/c1-14-8(11)5-2-6(9(12)13)4-7(10)3-5/h2-4,12-13H,1H3
InChI key:InChIKey=XRIPARKZRWXMTC-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=CC(B(O)O)=CC(Cl)=C1
Synonyms:
  • 1-Methyl 3-borono-5-chlorobenzoate
  • 3-Chloro-5-(methoxycarbonyl)phenylboronic acid
  • [3-Chloro-5-(methoxycarbonyl)phenyl]boronic acid
  • Benzoic acid, 3-borono-5-chloro-, 1-methyl ester
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