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CAS 877399-31-0

:

1,1-Dimethylethyl 3-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]methyl]-1-azetidinecarboxylate

Description:
1,1-Dimethylethyl 3-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]methyl]-1-azetidinecarboxylate, with CAS number 877399-31-0, is a complex organic compound characterized by its unique structural features. It contains an azetidine ring, which is a four-membered nitrogen-containing heterocycle, and a carboxylate functional group that contributes to its reactivity and potential applications in organic synthesis. The presence of a pyrazole moiety, known for its biological activity, suggests potential pharmacological properties. Additionally, the incorporation of a boron-containing group, specifically a dioxaborolane, may enhance its utility in various chemical reactions, including cross-coupling reactions in medicinal chemistry. The tert-butyl group (1,1-dimethylethyl) provides steric hindrance, which can influence the compound's stability and reactivity. Overall, this compound's intricate structure and functional groups make it a subject of interest in both synthetic and medicinal chemistry, potentially leading to novel applications in drug development and material science.
Formula:C18H30BN3O4
InChI:InChI=1S/C18H30BN3O4/c1-16(2,3)24-15(23)21-9-13(10-21)11-22-12-14(8-20-22)19-25-17(4,5)18(6,7)26-19/h8,12-13H,9-11H2,1-7H3
InChI key:InChIKey=DOHIZYSNAUZWCR-UHFFFAOYSA-N
SMILES:C(N1C=C(C=N1)B2OC(C)(C)C(C)(C)O2)C3CN(C(OC(C)(C)C)=O)C3
Synonyms:
  • 1,1-Dimethylethyl 3-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]methyl]-1-azetidinecarboxylate
  • 2-[1-[(1-Bocazetidin-3-yl)methyl]-1H-pyrazol-4-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
  • 1-Azetidinecarboxylic acid, 3-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]methyl]-, 1,1-dimethylethyl ester
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