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CS-W001157 4
Total: USD 88.00

4-Nitro-5-propyl-1H-pyrazole-3-carboxamide

  • CAS No. 139756-08-4

  • Cat. No. CS-0445694
  • Molecule weight198.18
  • Purity≥98%
  • MDL No.None

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

4-Nitro-5-propyl-1H-pyrazole-3-carboxamide|CS-0445694

Structure of 139756-08-4

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General Information

  • CAS No. 139756-08-4
  • Cat. No. CS-0445694
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₀N₄O₃
  • Molecular Weight 198.18
  • Synonym(s) 4-nitro-3-propyl-1H-pyrazole-5-carboxamide
  • SMILES CCCC1=C(C(=NN1)C(=O)N)[N+](=O)[O-]

Synthesis

  • Route1
    • 4-Nitro-5-propyl-1H-pyrazole-3-carboxylic acid|CS-0728989
      76424-48-1
    • null|null
      1336-21-6
    • ~13%
    • 4-Nitro-5-propyl-1H-pyrazole-3-carboxamide|CS-0445694
      139756-08-4

    References

    • Cell Pathways, Inc. Patent: US6200980 B1, 2001 ;
  • Route2
    • 4-Nitro-5-propyl-1H-pyrazole-3-carboxylic acid|CS-0728989
      76424-48-1
    • ~%
    • 4-Nitro-5-propyl-1H-pyrazole-3-carboxamide|CS-0445694
      139756-08-4

    References

    • Haning, Helmut; Niewoehner, Ulrich; Schenke, Thomas; Lampe, Thomas; Hillisch, Alexander; Bischoff, Erwin Bioorganic and Medicinal Chemistry Letters, 2005 , vol. 15, # 17 p. 3900 - 3907
  • Route3
    • 3-Propyl-1H-pyrazole-5-carboxylic acid|CS-0152421
      76424-47-0
    • ~%
    • 4-Nitro-5-propyl-1H-pyrazole-3-carboxamide|CS-0445694
      139756-08-4

    References

    • Haning, Helmut; Niewoehner, Ulrich; Schenke, Thomas; Lampe, Thomas; Hillisch, Alexander; Bischoff, Erwin Bioorganic and Medicinal Chemistry Letters, 2005 , vol. 15, # 17 p. 3900 - 3907

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   114.91
  • LogP   0.3693
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   4

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