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CAS 445303-11-7

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2-(4-Chloro-3-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Description:
2-(4-Chloro-3-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane is an organoboron compound characterized by its unique dioxaborolane structure, which features a boron atom bonded to two oxygen atoms and a carbon framework. This compound typically exhibits a stable, cyclic structure that contributes to its reactivity in various chemical reactions, particularly in cross-coupling reactions, making it valuable in organic synthesis and medicinal chemistry. The presence of the chloro and methyl substituents on the phenyl ring can influence its electronic properties and steric hindrance, affecting its reactivity and interaction with other molecules. Additionally, the tetramethyl groups enhance the compound's solubility and stability in organic solvents. As with many organoboron compounds, it may serve as a versatile intermediate in the synthesis of pharmaceuticals, agrochemicals, and other functional materials. Safety data should be consulted for handling and storage, as organoboron compounds can have specific hazards associated with their use.
Formula:C13H18BClO2
InChI:InChI=1S/C13H18BClO2/c1-9-8-10(6-7-11(9)15)14-16-12(2,3)13(4,5)17-14/h6-8H,1-5H3
InChI key:InChIKey=IVNMVIMOKWBLKH-UHFFFAOYSA-N
SMILES:CC1(C)OB(OC1(C)C)C2=CC(C)=C(Cl)C=C2
Synonyms:
  • 2-(4-Chloro-3-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
  • 1,3,2-Dioxaborolane, 2-(4-chloro-3-methylphenyl)-4,4,5,5-tetramethyl-
  • 2-(4-Chloro-3-methylphenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane
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