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CS-W001157 4
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Ethyl 3-cyano-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxylate

  • CAS No. 64689-83-4

  • Cat. No. CS-0080976
  • Molecule weight232.20
  • Purity≥98%
  • MDL No.MFCD00793850

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

Ethyl 3-cyano-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxylate|CS-0080976

Structure of 64689-83-4

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General Information

  • CAS No. 64689-83-4
  • Cat. No. CS-0080976
  • Purity ≥98%
  • MDL No. MFCD00793850
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈N₄O₃
  • Molecular Weight 232.20
  • Synonym(s) Pyrazolo[1,5-a]pyrimidine-6-carboxylic acid, 3-cyano-4,7-dihydro-7-oxo-, ethyl ester
  • SMILES O=C(C1=CNC2=C(C#N)C=NN2C1=O)OCC

Synthesis

  • Route1
    • null|null
      155374-22-4
    • ~68%
    • Ethyl 3-cyano-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxylate|CS-0080976
      64689-83-4

    References

    • Nagahara; Kawano; Sasaoka; Ukawa; Hirama; Takada; Cottam; Robins Journal of Heterocyclic Chemistry, 1994 , vol. 31, # 1 p. 239 - 243
  • Route2

    References

    • Nagahara; Kawano; Sasaoka; Ukawa; Hirama; Takada; Cottam; Robins Journal of Heterocyclic Chemistry, 1994 , vol. 31, # 1 p. 239 - 243
  • Route3

    References

    • Nagahara; Kawano; Sasaoka; Ukawa; Hirama; Takada; Cottam; Robins Journal of Heterocyclic Chemistry, 1994 , vol. 31, # 1 p. 239 - 243

Safety Information

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Computational Chemistry Data

  • TPSA   100.25
  • LogP   0.07098
  • H_Acceptors   6
  • H_Donors   1
  • Rotatable_Bonds   2

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