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CAS 1218790-98-7

:

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

Description:
1-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclopropanecarboxylic acid is a chemical compound characterized by its unique structural features, including a cyclopropanecarboxylic acid moiety and a phenyl group substituted with a boron-containing dioxaborolane. The presence of the dioxaborolane group suggests potential applications in organic synthesis and medicinal chemistry, particularly in the context of boron chemistry, which is known for its utility in various reactions, including Suzuki coupling. The cyclopropane ring contributes to the compound's rigidity and may influence its reactivity and interaction with biological targets. This compound is likely to exhibit moderate solubility in organic solvents, and its acidic carboxylic group can participate in hydrogen bonding and other interactions, affecting its overall chemical behavior. Additionally, the bulky tetramethyl groups may provide steric hindrance, influencing the compound's reactivity and stability. Overall, this compound's unique structure positions it as a potentially valuable intermediate or building block in synthetic organic chemistry.
Formula:C16H21BO4
InChI:InChI=1S/C16H21BO4/c1-14(2)15(3,4)21-17(20-14)12-7-5-11(6-8-12)16(9-10-16)13(18)19/h5-8H,9-10H2,1-4H3,(H,18,19)
InChI key:InChIKey=YZWDIFNCAKRQCL-UHFFFAOYSA-N
SMILES:C(O)(=O)C1(CC1)C2=CC=C(C=C2)B3OC(C)(C)C(C)(C)O3
Synonyms:
  • 4-(1-Carboxycyclopropyl)phenylboronic acid pinacol ester
  • 1-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclopropanecarboxylic acid
  • Cyclopropanecarboxylic acid, 1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-
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