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CS-W001157 4
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Methyl 4-methyl-1H-pyrazole-3-carboxylate

  • CAS No. 68809-58-5

  • Cat. No. CS-0021078
  • Purity≥95%
  • MDL No.MFCD00159649

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

Methyl 4-methyl-1H-pyrazole-3-carboxylate|CS-0021078

Structure of 68809-58-5

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General Information

  • CAS No. 68809-58-5
  • Cat. No. CS-0021078
  • Purity ≥95%
  • MDL No. MFCD00159649
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₈N₂O₂
  • Molecular Weight 140.14
  • Synonym(s) 1H-Pyrazole-3-carboxylicacid,4-methyl-,methylester(9ci)
  • SMILES O=C(C1=NNC=C1C)OC

Synthesis

  • Route1

    References

    • Chan, Kin Shing; Wulff, William D. Journal of the American Chemical Society, 1986 , vol. 108, # 17 p. 5229 - 5236
  • Route2
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      18107-18-1
    • ~%
    • In-stock
      Methyl 4-methyl-1H-pyrazole-3-carboxylate|CS-0021078
      68809-58-5

    References

    • Chan, Kin Shing; Wulff, William D. Journal of the American Chemical Society, 1986 , vol. 108, # 17 p. 5229 - 5236
  • Route3
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      186581-53-3
    • null|null
      623-43-8
    • ~%
    • In-stock
      Methyl 4-methyl-1H-pyrazole-3-carboxylate|CS-0021078
      68809-58-5

    References

    • v.Pechmann; Burkard Chemische Berichte, 1900 , vol. 33, p. 3595 Full Text Show Details v.Auwers; Koenig Justus Liebigs Annalen der Chemie, 1932 , vol. 496, p. 27,267 Full Text Show Details v.Auwers; Cauer Justus Liebigs Annalen der Chemie, 1929 , vol. 470, p. 298

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   54.98
  • LogP   0.50472
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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