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Ethyl 5-amino-1-(4-chlorophenyl)-4-cyanopyrazole-3-carboxylate

  • CAS No. 908584-68-9

  • Cat. No. CS-0212493
  • Molecule weight290.71
  • Purity≥98%
  • MDL No.MFCD09835737

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

Ethyl 5-amino-1-(4-chlorophenyl)-4-cyanopyrazole-3-carboxylate|CS-0212493

Structure of 908584-68-9

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General Information

  • CAS No. 908584-68-9
  • Cat. No. CS-0212493
  • Purity ≥98%
  • MDL No. MFCD09835737
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₁ClN₄O₂
  • Molecular Weight 290.71
  • Synonym(s) Ethyl 5-amino-1-(4-chlorophenyl)-4-cyano-1H-pyrazole-3-carboxylate
  • SMILES CCOC(=O)C1=NN(C2=CC=C(C=C2)Cl)C(=C1C#N)N

Synthesis

  • Route1

    References

    • Silvestri, Romano; Cascio, Maria Grazia; La Regina, Giuseppe; Piscitelli, Francesco; Lavecchia, Antonio; Brizzi, Antonella; Pasquini, Serena; Botta, Maurizio; Novellino, Ettore; Di Marzo, Vincenzo; Corelli, Federico Journal of Medicinal Chemistry, 2008 , vol. 51, # 6 p. 1560 - 1576
  • Route2

    References

    • Ge, Min; Cline, Eric; Yang, Lihu Tetrahedron Letters, 2006 , vol. 47, # 32 p. 5797 - 5799

Safety Information

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Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   93.93
  • LogP   2.15628
  • H_Acceptors   6
  • H_Donors   1
  • Rotatable_Bonds   3

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