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CAS 957065-99-5

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2-Pyridinecarboxylicacid, 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester

Description:
2-Pyridinecarboxylic acid, 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester, identified by CAS number 957065-99-5, is a chemical compound that features a pyridine ring substituted with a carboxylic acid and a boron-containing moiety. This compound is characterized by its unique structure, which includes a methyl ester functional group that enhances its solubility and reactivity. The presence of the dioxaborolane group suggests potential applications in organic synthesis, particularly in cross-coupling reactions and as a boron source in various chemical transformations. The compound is likely to exhibit moderate polarity due to the combination of the polar carboxylic acid and the non-polar dioxaborolane moiety. Its stability and reactivity can be influenced by the steric hindrance introduced by the tetramethyl groups. Overall, this compound may serve as a valuable intermediate in the synthesis of more complex organic molecules, particularly in medicinal chemistry and materials science.
Formula:C13H18BNO4
InChI:InChI=1S/C13H18BNO4/c1-12(2)13(3,4)19-14(18-12)9-6-7-10(15-8-9)11(16)17-5/h6-8H,1-5H3
InChI key:IXKFGVRURWXXKX-UHFFFAOYSA-N
SMILES:B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)C(=O)OC
Synonyms:
  • 5-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridine-2-carboxylicacid methyl ester
  • Methyl5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate
  • 2-(Methylcarboxy)pyridine-5-boronicacidpinacolester
  • Methyl 5-(Tetramethyl-1,3,2-Dioxaborolan-2-Yl)Pyridine-2-Carboxylate
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