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CAS 943323-56-6

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4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridin-6-amine

Description:
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridin-6-amine is a chemical compound characterized by its unique structural features, which include a pyrrolo[2,3-b]pyridine core and a boron-containing dioxaborolane moiety. The presence of the dioxaborolane group suggests potential applications in organoboron chemistry, particularly in cross-coupling reactions and as a building block in organic synthesis. The compound is likely to exhibit moderate to high polarity due to the presence of both nitrogen and boron atoms, which can influence its solubility in various solvents. Additionally, the tetramethyl substituents contribute to steric hindrance, potentially affecting its reactivity and interaction with other molecules. Its amine functional group may also participate in hydrogen bonding, enhancing its potential as a ligand in coordination chemistry. Overall, this compound's distinctive structure and functional groups make it a candidate for research in medicinal chemistry and materials science.
Formula:C13H18BN3O2
InChI:InChI=1S/C13H18BN3O2/c1-12(2)13(3,4)19-14(18-12)9-7-10(15)17-11-8(9)5-6-16-11/h5-7H,1-4H3,(H3,15,16,17)
InChI key:InChIKey=IQIYEKPOPONDGX-UHFFFAOYSA-N
SMILES:NC1=CC(=C2C(=N1)NC=C2)B3OC(C)(C)C(C)(C)O3
Synonyms:
  • 1H-Pyrrolo[2,3-b]pyridin-6-amine, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
  • 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridin-6-amine
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