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CAS 2121512-00-1

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2-[2-Bromo-6-fluoro-3-(methylthio)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Description:
2-[2-Bromo-6-fluoro-3-(methylthio)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane is a boron-containing organic compound characterized by its unique structural features. The presence of a dioxaborolane ring contributes to its reactivity, particularly in cross-coupling reactions, making it valuable in synthetic organic chemistry. The bromine and fluorine substituents on the phenyl ring enhance its electrophilic properties, while the methylthio group can influence its solubility and reactivity. This compound is likely to exhibit moderate to high stability under standard conditions, but may be sensitive to moisture due to the presence of boron. Its applications may include use as a reagent in organic synthesis, particularly in the formation of carbon-carbon bonds. Additionally, the specific arrangement of substituents can affect its biological activity, making it a candidate for further investigation in medicinal chemistry. Overall, this compound exemplifies the intricate interplay of functional groups in determining the chemical behavior and potential applications of organoboron compounds.
Formula:C13H17BBrFO2S
InChI:InChI=1S/C13H17BBrFO2S/c1-12(2)13(3,4)18-14(17-12)10-8(16)6-7-9(19-5)11(10)15/h6-7H,1-5H3
InChI key:InChIKey=SVELRARRTWFWKN-UHFFFAOYSA-N
SMILES:BrC1=C(B2OC(C)(C)C(C)(C)O2)C(F)=CC=C1SC
Synonyms:
  • 1,3,2-Dioxaborolane, 2-[2-bromo-6-fluoro-3-(methylthio)phenyl]-4,4,5,5-tetramethyl-
  • 2-[2-Bromo-6-fluoro-3-(methylthio)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
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