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CS-W001157 4
Total: USD 88.00

2-Methoxy-6-methylpyrimidin-4(1H)-one

  • CAS No. 55996-28-6

  • Cat. No. CS-0045777
  • Purity≥98%
  • MDL No.MFCD00075787

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

2-Methoxy-6-methylpyrimidin-4(1H)-one|CS-0045777

Structure of 55996-28-6

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General Information

  • CAS No. 55996-28-6
  • Cat. No. CS-0045777
  • Purity ≥98%
  • MDL No. MFCD00075787
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₈N₂O₂
  • Molecular Weight 140.14
  • Synonym(s) 2-methoxy-4-methyl-6-hydroxypyrimidine
  • SMILES OC1=NC(OC)=NC(C)=C1

Description

2-Methoxy-6-methylpyrimidin-4(1H)-one features a pyrimidinone core with orthogonal methoxy and methyl substituents, enhancing solubility and metabolic stability. This electron-deficient heterocycle integrates readily into medicinal chemistry scaffolds, serving as a key building block for kinase inhibitors and antiviral agents under standard bench conditions.

Application

2-Methoxy-6-methylpyrimidin-4(1H)-one serves as a versatile building block in medicinal chemistry, enabling efficient access to pyrimidine-based scaffolds. Its functional group pattern—methoxy and methyl substituents at C2 and C6, respectively—confers enhanced stability and favorable solubility for downstream transformations. The compound readily participates in palladium-catalyzed cross-coupling reactions and functions as a key intermediate in the synthesis of heterocyclic APIs and kinase inhibitors.

Synthesis

  • Route1

    References

    • Botta, M.; Cavalieri, M.; Ceci, D.; Angelis, F. De; Finizia, G.; Nicoletti, R. Tetrahedron, 1984 , vol. 40, # 17 p. 3313 - 3320
  • Route2
    • null|null
      67-56-1
    • In-stock
      Ethyl acetoacetate|CS-0016216
      141-97-9
    • null|null
      17356-08-0
    • ~10%
    • In-stock
      2-Methoxy-6-methylpyrimidin-4(1H)-one|CS-0045777
      55996-28-6

    References

    • Botta, Maurizio; Corelli, Federico; Maga, Giovanni; Manetti, Fabrizio; Renzulli, Michela; Spadari, Silvio Tetrahedron, 2001 , vol. 57, # 39 p. 8357 - 8367
  • Route3
    • null|null
      67-56-1
    • ~96%
    • In-stock
      2-Methoxy-6-methylpyrimidin-4(1H)-one|CS-0045777
      55996-28-6

    References

    • Petricci, Elena; Renzulli, Michela; Radi, Marco; Corelli, Federico; Botta, Maurizio Tetrahedron Letters, 2002 , vol. 43, # 52 p. 9667 - 9670

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   55.24
  • LogP   0.49922
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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