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CAS 1150271-68-3

:

Methyl 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzodioxole-5-acetate

Description:
Methyl 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzodioxole-5-acetate is a chemical compound characterized by its complex structure, which includes a benzodioxole moiety and a dioxaborolane group. This compound typically exhibits properties associated with both organic boron compounds and aromatic systems, such as potential reactivity in cross-coupling reactions, which are valuable in synthetic organic chemistry. The presence of the dioxaborolane group suggests it may participate in boron-mediated reactions, making it useful in the formation of carbon-carbon bonds. Additionally, the methyl ester functional group indicates that it may undergo hydrolysis to yield the corresponding acid, which could further participate in various chemical transformations. The compound's solubility, stability, and reactivity can be influenced by the steric hindrance introduced by the tetramethyl groups, as well as the electronic effects of the benzodioxole structure. Overall, this compound is of interest in the field of medicinal chemistry and materials science due to its potential applications in drug development and organic synthesis.
Formula:C16H21BO6
InChI:InChI=1S/C16H21BO6/c1-15(2)16(3,4)23-17(22-15)11-6-10(8-13(18)19-5)7-12-14(11)21-9-20-12/h6-7H,8-9H2,1-5H3
InChI key:InChIKey=WOHOTRCEMIIOEP-UHFFFAOYSA-N
SMILES:CC1(C)OB(OC1(C)C)C2=C3C(=CC(CC(OC)=O)=C2)OCO3
Synonyms:
  • Methyl 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzodioxole-5-acetate
  • 1,3-Benzodioxole-5-acetic acid, 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester
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