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CS-W001157 4
Total: USD 88.00

3,4-Dimethyl 1h-pyrazole-3,4-dicarboxylate

  • CAS No. 33090-46-9

  • Cat. No. CS-0214899
  • Purity≥96%
  • MDL No.None

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

3,4-Dimethyl 1h-pyrazole-3,4-dicarboxylate|CS-0214899

Structure of 33090-46-9

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General Information

  • CAS No. 33090-46-9
  • Cat. No. CS-0214899
  • Purity ≥96%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈N₂O₄
  • Molecular Weight 184.15
  • Synonym(s) dimethyl 1H-pyrazole-4,5-dicarboxylate
  • SMILES COC(=O)C1=CNN=C1C(=O)OC

Synthesis

  • Route1

    References

    • GLAXOSMITHKLINE LLC; HAYDAR, Simon N.; JOHNS, Brian Alvin; VELTHUISEN, Emile Johann Patent: WO2013/43553 A1, 2013 ; Location in patent: Page/Page column 145 ;
  • Route2

    References

    • MICURX PHARMACEUTICALS, INC. Patent: WO2008/108988 A1, 2008 ; Location in patent: Page/Page column 57; 58 ;
  • Route3
    • null|null
      624-48-6
    • null|null
      87879-93-4
    • ~25%
    • 3,4-Dimethyl 1h-pyrazole-3,4-dicarboxylate|CS-0214899
      33090-46-9

    References

    • Coe, Paul L.; Cook, Michael I. Journal of Fluorine Chemistry, 1989 , vol. 45, p. 323 - 330

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   81.28
  • LogP   -0.0171
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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