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Ethyl 1-(6-bromopyridin-2-yl)-5-methyl-1H-pyrazole-4-carboxylate

  • CAS No. 1536648-98-2

  • Cat. No. CS-W000614
  • Molecule weight310.15
  • Purity≥98%
  • MDL No.None

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

Ethyl 1-(6-bromopyridin-2-yl)-5-methyl-1H-pyrazole-4-carboxylate|CS-W000614

Structure of 1536648-98-2

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General Information

  • CAS No. 1536648-98-2
  • Cat. No. CS-W000614
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₂BrN₃O₂
  • Molecular Weight 310.15
  • Synonym(s) None
  • SMILES Cc1c(cnn1c1cccc(n1)Br)C(=O)OCC

Description

Ethyl 1-(6-bromopyridin-2-yl)-5-methyl-1H-pyrazole-4-carboxylate features a brominated pyridine moiety paired with a methyl-substituted pyrazole core, enabling efficient coupling in cross-coupling reactions. The ester group facilitates derivatization, while the electron-deficient pyridine enhances reactivity in transition metal catalysis. This compound serves as a key intermediate in the synthesis of bioactive heterocycles and pharmaceutical candidates.

Application

Ethyl 1-(6-bromopyridin-2-yl)-5-methyl-1H-pyrazole-4-carboxylate serves as a versatile building block for constructing biologically relevant heterocyclic scaffolds. The 6-bromopyridyl moiety enables palladium-catalyzed cross-coupling reactions, while the pyrazole core provides orthogonal functionalization potential. Its bench-stable nature and compatibility with standard synthetic protocols facilitate efficient access to complex molecular architectures in medicinal chemistry and process development.

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   2.51492
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   3

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