CAS 1445651-59-1

2-(Difluoromethoxy)-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

Description:

2-(Difluoromethoxy)-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine is a complex organic compound characterized by its unique functional groups and structural features. The presence of a pyridine ring contributes to its aromatic properties, while the difluoromethoxy group introduces significant electronegativity, potentially influencing its reactivity and solubility. The incorporation of a boron-containing moiety, specifically a dioxaborolane, suggests potential applications in organoboron chemistry, particularly in cross-coupling reactions or as a reagent in synthetic pathways. The compound's molecular structure indicates it may exhibit interesting electronic properties due to the interplay between the electron-withdrawing difluoromethoxy group and the electron-rich boron center. Additionally, the steric bulk provided by the tetramethyl groups can affect the compound's reactivity and interactions with other molecules. Overall, this compound may serve as a valuable intermediate in organic synthesis or as a building block in the development of pharmaceuticals or agrochemicals.

Formula: C₁₃H₁₈BF₂NO₃

InChI: InChI=1S/C13H18BF2NO3/c1-8-6-9(7-17-10(8)18-11(15)16)14-19-12(2,3)13(4,5)20-14/h6-7,11H,1-5H3

InChI key: InChIKey=GOACIWGATFBWSQ-UHFFFAOYSA-N

SMILES: CC1(C)OB(OC1(C)C)C=2C=C(C)C(OC(F)F)=NC2

Synonyms:

• 2-(Difluoromethoxy)-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
• Pyridine, 2-(difluoromethoxy)-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
• 2-(Difluoromethoxy)-3-methyl-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine