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CS-W001157 4
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tert-Butyl 3-bromo-1H-pyrazolo[3,4-b]pyridine-1-carboxylate

  • CAS No. 1234616-46-6

  • Cat. No. CS-W023155
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

tert-Butyl 3-bromo-1H-pyrazolo[3,4-b]pyridine-1-carboxylate|CS-W023155

Structure of 1234616-46-6

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General Information

  • CAS No. 1234616-46-6
  • Cat. No. CS-W023155
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₂BrN₃O₂
  • Molecular Weight 298.14
  • Synonym(s) tert-Butyl 3-Bromopyrazolo[3,4-b]pyridine-1-carboxylate
  • SMILES CC(C)(C)OC(=O)n1nc(Br)c2cccnc12

Description

tert-Butyl 3-bromo-1H-pyrazolo[3,4-b]pyridine-1-carboxylate features a brominated pyrazolopyridine core with a bench-stable tert-butyl ester handle. This building block integrates readily into cross-coupling reactions, enabling efficient access to functionalized heterocycles. The electron-deficient pyrazolo[3,4-b]pyridine scaffold supports diverse derivatization for medicinal chemistry and materials applications.

Application

tert-Butyl 3-bromo-1H-pyrazolo[3,4-b]pyridine-1-carboxylate serves as a versatile building block for the synthesis of pyrazolopyridine-based scaffolds. The bromine substituent enables palladium-catalyzed cross-coupling reactions, while the tert-butyl ester group offers stability and ease of subsequent deprotection. This compound functions effectively in diversification strategies for medicinal chemistry and materials science applications.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   57.01
  • LogP   2.977
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   0

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