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CAS 874219-45-1

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1-Methyl 5-borono-2-chlorobenzoate

Description:
1-Methyl 5-borono-2-chlorobenzoate is an organic compound characterized by its boronic acid derivative structure, which includes a boron atom bonded to a phenyl ring. This compound features a methyl group and a chlorine atom attached to the aromatic system, contributing to its unique reactivity and properties. The presence of the boron functional group makes it particularly useful in Suzuki coupling reactions, a common method in organic synthesis for forming carbon-carbon bonds. The chlorobenzoate moiety enhances its solubility in organic solvents and can participate in various chemical transformations. Typically, compounds like this are utilized in medicinal chemistry and materials science due to their ability to act as intermediates in the synthesis of more complex molecules. Additionally, the compound's stability, reactivity, and functional group compatibility make it a valuable building block in the development of pharmaceuticals and agrochemicals. Safety data should be consulted for handling and storage, as with all chemical substances.
Formula:C8H8BClO4
InChI:InChI=1S/C8H8BClO4/c1-14-8(11)6-4-5(9(12)13)2-3-7(6)10/h2-4,12-13H,1H3
InChI key:InChIKey=YEPWHDGFBVDINZ-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=CC(B(O)O)=CC=C1Cl
Synonyms:
  • 1-Methyl 5-borono-2-chlorobenzoate
  • 4-Chloro-3-(methoxycarbonyl)phenylboronic acid
  • 4-Chloro-3-(methoxycarbonyl)phenylboronicacid
  • Benzoic Acid, 5-Borono-2-Chloro-, Methyl Ester
  • Benzoic acid, 5-borono-2-chloro-, 1-methyl ester
  • (4-Chloro-3-(methoxycarbonyl)phenyl)boronic acid
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