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CS-W001157 4
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5-(Dimethoxymethyl)-1H-pyrazole

  • CAS No. 111573-59-2

  • Cat. No. CS-0061890
  • Molecule weightNone
  • Purity≥97%
  • MDL No.MFCD00085025

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

5-(Dimethoxymethyl)-1H-pyrazole|CS-0061890

Structure of 111573-59-2

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General Information

  • CAS No. 111573-59-2
  • Cat. No. CS-0061890
  • Purity ≥97%
  • MDL No. MFCD00085025
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₀N₂O₂
  • Molecular Weight None
  • Synonym(s) 3-(DIMETHOXYMETHYL)PYRAZOLE
  • SMILES COC(C1=NNC=C1)OC

Description

5-(Dimethoxymethyl)-1H-pyrazole integrates a dimethoxymethyl group at the 5-position of the pyrazole ring, delivering enhanced solubility and stability under standard conditions. This functionalized scaffold serves as a key intermediate in medicinal chemistry, enabling efficient coupling strategies in target-oriented synthesis.

Application

5-(Dimethoxymethyl)-1H-pyrazole serves as a versatile building block for heterocyclic synthesis, enabling efficient access to pyrazole-based scaffolds through standard functional group transformations. The dimethoxymethyl group provides bench stability and facilitates selective deprotection or nucleophilic substitution under mild conditions, offering predictable reactivity in medicinal chemistry and process development workflows.

Synthesis

  • Route1

    References

    • Allin, Steven M.; Barton, William R.S.; Russell Bowman; Bridge (nee Mann), Emma; Elsegood, Mark R.J.; McInally, Tom; McKee, Vickie Tetrahedron, 2008 , vol. 64, # 33 p. 7745 - 7758
  • Route2
    • null|null
      67-56-1
    • In-stock
      1H-Pyrazole-3-carbaldehyde|CS-W004202
      3920-50-1
    • ~79%
    • In-stock
      5-(Dimethoxymethyl)-1H-pyrazole|CS-0061890
      111573-59-2

    References

    • Gregg, Brian T.; Golden, Kathryn C.; Quinn, John F. Tetrahedron, 2008 , vol. 64, # 15 p. 3287 - 3295
  • Route3

    References

    • European Journal of Medicinal Chemistry, , vol. 28, # 2 p. 129 - 140

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   47.14
  • LogP   0.7011
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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