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CAS 957061-13-1

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2-[4-(3-Bromopropoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Description:
2-[4-(3-Bromopropoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane is a boron-containing organic compound characterized by its unique dioxaborolane structure, which features a five-membered ring containing boron and oxygen atoms. This compound includes a phenyl group substituted with a 3-bromopropoxy moiety, contributing to its potential reactivity and solubility properties. The presence of the bromine atom may enhance its electrophilic character, making it useful in various chemical reactions, including cross-coupling reactions in organic synthesis. The tetramethyl substituents on the dioxaborolane ring provide steric hindrance, which can influence the compound's stability and reactivity. This compound is of interest in medicinal chemistry and materials science, particularly in the development of boron-based reagents and catalysts. Its specific properties, such as solubility, melting point, and reactivity, would depend on the surrounding conditions and the presence of other functional groups in a given reaction environment. Safety and handling precautions should be observed due to the presence of bromine and the potential for reactivity.
Formula:C15H22BBrO3
InChI:InChI=1S/C15H22BBrO3/c1-14(2)15(3,4)20-16(19-14)12-6-8-13(9-7-12)18-11-5-10-17/h6-9H,5,10-11H2,1-4H3
InChI key:InChIKey=YSXHRXGAAAOXSO-UHFFFAOYSA-N
SMILES:CC1(C)OB(OC1(C)C)C2=CC=C(OCCCBr)C=C2
Synonyms:
  • 2-[4-(3-Bromopropoxy)phenyl]-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane
  • 2-[4-(3-Bromopropoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
  • 1,3,2-Dioxaborolane, 2-[4-(3-bromopropoxy)phenyl]-4,4,5,5-tetramethyl-
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