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CAS 445303-67-3

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

Description:
2-[3-Fluoro-4-(trifluoromethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane is a boron-containing organic compound characterized by its unique structural features, including a dioxaborolane ring and a substituted phenyl group. The presence of the trifluoromethyl and fluoro groups on the phenyl ring enhances its lipophilicity and may influence its reactivity and interaction with biological systems. This compound is typically used in organic synthesis, particularly in the formation of carbon-boron bonds, which are crucial in various coupling reactions, such as Suzuki-Miyaura cross-coupling. The dioxaborolane moiety is known for its stability and ability to act as a boron source in chemical reactions. Additionally, the steric hindrance provided by the tetramethyl groups can affect the compound's reactivity and selectivity in synthetic applications. Overall, this compound is of interest in both academic research and industrial applications, particularly in the development of pharmaceuticals and agrochemicals.
Formula:C13H15BF4O2
InChI:InChI=1S/C13H15BF4O2/c1-11(2)12(3,4)20-14(19-11)8-5-6-9(10(15)7-8)13(16,17)18/h5-7H,1-4H3
InChI key:InChIKey=FPCSARGPMNDYAO-UHFFFAOYSA-N
SMILES:CC1(C)OB(OC1(C)C)C2=CC(F)=C(C(F)(F)F)C=C2
Synonyms:
  • 1,3,2-Dioxaborolane, 2-[3-fluoro-4-(trifluoromethyl)phenyl]-4,4,5,5-tetramethyl-
  • 3-Fluoro-4-(trifluoromethyl)phenylboronic acid pinacol ester
  • 2-[3-Fluoro-4-(trifluoromethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
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