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CS-W001157 4
Total: USD 88.00

Ethyl 5-cyano-1H-pyrazole-4-carboxylate

  • CAS No. 119741-57-0

  • Cat. No. CS-0054355
  • Molecule weight165.15
  • Purity≥97%
  • MDL No.MFCD18917036

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

Ethyl 5-cyano-1H-pyrazole-4-carboxylate|CS-0054355

Structure of 119741-57-0

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General Information

  • CAS No. 119741-57-0
  • Cat. No. CS-0054355
  • Purity ≥97%
  • MDL No. MFCD18917036
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇N₃O₂
  • Molecular Weight 165.15
  • Synonym(s) ethyl 3-cyano-1H-pyrazole-4-carboxylate
  • SMILES O=C(C1=C(C#N)NN=C1)OCC

Synthesis

  • Route1
    • null|null
      119741-54-7
    • ~92%
    • Ethyl 5-cyano-1H-pyrazole-4-carboxylate|CS-0054355
      119741-57-0

    References

    • Tao, E. V. P.; Aikins, J.; Rizzo, J.; Beck, J. R.; Lynch, M. P. Journal of Heterocyclic Chemistry, 1988 , vol. 25, p. 1293 - 1294
  • Route2
    • null|null
      127049-85-8
    • ~%
    • Ethyl 5-cyano-1H-pyrazole-4-carboxylate|CS-0054355
      119741-57-0

    References

    • Tao, E. V. P.; Rizzo, John R.; Aikins, James Journal of Heterocyclic Chemistry, 1990 , vol. 27, # 6 p. 1655 - 1656
  • Route3

    References

    • Tao, E. V. P.; Rizzo, John R.; Aikins, James Journal of Heterocyclic Chemistry, 1990 , vol. 27, # 6 p. 1655 - 1656

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   78.77
  • LogP   0.45808
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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