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Ethyl 3-ethyl-1H-pyrazole-4-carboxylate

  • CAS No. 73981-23-4

  • Cat. No. CS-0152476
  • Purity≥97%
  • MDL No.MFCD07367317

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

Ethyl 3-ethyl-1H-pyrazole-4-carboxylate|CS-0152476

Structure of 73981-23-4

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General Information

  • CAS No. 73981-23-4
  • Cat. No. CS-0152476
  • Purity ≥97%
  • MDL No. MFCD07367317
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₂N₂O₂
  • Molecular Weight 168.19
  • Synonym(s) ETHYL-3-ETHYLPYRAZOLE-4-CARBOXYLATE
  • SMILES CCC1=NNC=C1C(=O)OCC

Description

Ethyl 3-ethyl-1H-pyrazole-4-carboxylate features a pyrazole core with strategically positioned ethyl and ester groups, enabling direct incorporation into heterocyclic scaffolds. This bench-stable reagent facilitates efficient access to biologically relevant pyrazole derivatives through coupling and cyclization reactions under standard conditions.

Application

Ethyl 3-ethyl-1H-pyrazole-4-carboxylate serves as a versatile building block in heterocyclic synthesis, enabling efficient access to substituted pyrazole scaffolds via standard functional group manipulations. The ethyl ester facilitates straightforward hydrolysis and coupling reactions, while the 3-ethyl substituent provides steric and electronic modulation for downstream derivatization. Its bench-stable nature and compatibility with common reaction conditions make it well-suited for medicinal chemistry campaigns and process development workflows.

Synthesis

  • Route1
    • Pentanoic acid, 2-[(dimethylamino)methylene]-3-oxo-, ethyl ester|CS-0677202
      89193-23-7
    • ~41%
    • In-stock
      Ethyl 3-ethyl-1H-pyrazole-4-carboxylate|CS-0152476
      73981-23-4

    References

    • Bolea, Christelle; Calanire, Sylvain Patent: US2010/144756 A1, 2010 ; Location in patent: Page/Page column 25 ; US 20100144756 A1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302
Precautionary Statements : P264-P270-P330

Quality Control

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Computational Chemistry Data

  • TPSA   54.98
  • LogP   1.1488
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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