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CAS 2096332-77-1

:

1-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1-butanone

Description:
1-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1-butanone, identified by its CAS number 2096332-77-1, is an organic compound featuring a ketone functional group and a boron-containing moiety. This compound typically exhibits characteristics associated with both aromatic and aliphatic structures, contributing to its unique reactivity and stability. The presence of the dioxaborolane group suggests potential applications in organic synthesis, particularly in cross-coupling reactions and as a reagent in various chemical transformations. The bulky tetramethyl substituents enhance steric hindrance, which can influence the compound's reactivity and solubility in different solvents. Additionally, the phenyl group provides aromatic stability, while the butanone moiety contributes to its overall polarity. Such compounds are often of interest in materials science and medicinal chemistry due to their potential utility in developing new pharmaceuticals or functional materials. Overall, this compound's unique structure and functional groups make it a valuable subject of study in organic chemistry.
Formula:C16H23BO3
InChI:InChI=1S/C16H23BO3/c1-6-7-14(18)12-8-10-13(11-9-12)17-19-15(2,3)16(4,5)20-17/h8-11H,6-7H2,1-5H3
InChI key:InChIKey=KXACZLKHSCCLGY-UHFFFAOYSA-N
SMILES:CC1(C)OB(OC1(C)C)C2=CC=C(C(CCC)=O)C=C2
Synonyms:
  • 1-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1-butanone
  • 1-Butanone, 1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-
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