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CS-W001157 4
Total: USD 88.00

1,3-Dimethyl-4-nitro-1h-pyrazol-5-amine

  • CAS No. 76689-64-0

  • Cat. No. CS-0230878
  • Molecule weight156.14
  • Purity≥97%
  • MDL No.None

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

1,3-Dimethyl-4-nitro-1h-pyrazol-5-amine|CS-0230878

Structure of 76689-64-0

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General Information

  • CAS No. 76689-64-0
  • Cat. No. CS-0230878
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₈N₄O₂
  • Molecular Weight 156.14
  • Synonym(s) 5-Amino-1,3-dimethyl-4-nitropyrazole
  • SMILES NC1=C([N+]([O-])=O)C(C)=NN1C

Synthesis

  • Route1
    • null|null
      76689-62-8
    • ~97%
    • 1,3-Dimethyl-4-nitro-1h-pyrazol-5-amine|CS-0230878
      76689-64-0

    References

    • Andreeva, M. A.; Bolotov, M. I.; Isaev, Sh. G.; Mushii, R. Ya.; Perevalov, V. P.; et al. J. Gen. Chem. USSR (Engl. Transl.), 1980 , vol. 50, # 9 p. 2116 - 2119,1714 - 1716
  • Route2
    • 5-Methyl-4-nitroisoxazole|CS-0451277
      1122-06-1
    • null|null
      60-34-4
    • ~86%
    • 1,3-Dimethyl-4-nitro-1h-pyrazol-5-amine|CS-0230878
      76689-64-0

    References

    • Katritzky, Alan R.; Vakulenko, Anatoliy V.; Sivapackiam, Jothilingam; Draghici, Bogdan; Damavarapu, Reddy Synthesis, 2008 , # 5 p. 699 - 706
  • Route3
    • null|null
      7339-53-9
    • null|null
      108161-06-4
    • ~80%
    • 1,3-Dimethyl-4-nitro-1h-pyrazol-5-amine|CS-0230878
      76689-64-0

    References

    • Alberola; Antolin; Gonzalez; et al. Journal of Heterocyclic Chemistry, 1986 , vol. 23, # 4 p. 1035 - 1038

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   86.98
  • LogP   0.21892
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   1

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