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CS-W001157 4
Total: USD 88.00

6-Methyl-1H-pyrazolo[3,4-d]pyrimidin-4(7H)-one

  • CAS No. 30129-57-8

  • Cat. No. CS-0152738
  • Purity≥97%
  • MDL No.MFCD11204654

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

6-Methyl-1H-pyrazolo[3,4-d]pyrimidin-4(7H)-one|CS-0152738

Structure of 30129-57-8

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General Information

  • CAS No. 30129-57-8
  • Cat. No. CS-0152738
  • Purity ≥97%
  • MDL No. MFCD11204654
  • Storage RT, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₆N₄O
  • Molecular Weight 150.14
  • Synonym(s) 6-methyl-1H-pyrazolo[3,4-djpyrimidin-4(5H)-one
  • SMILES O=C1C2=C(NN=C2)NC(C)=N1

Synthesis

  • Route1
    • null|null
      64-19-7
    • Allopurinol impurity 4|CS-0229685
      5334-31-6
    • ~60%
    • 6-Methyl-1H-pyrazolo[3,4-d]pyrimidin-4(7H)-one|CS-0152738
      30129-57-8

    References

    • Reddy, K Hemender; Reddy, A Panduranga; Veeranagaiah, V Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1992 , vol. 31, # 3 p. 163 - 166
  • Route2
    • null|null
      64-19-7
    • 3-Amino-4-pyrazolecarbonitrile Allopurinol Impurity|CS-0229543
      16617-46-2
    • ~75%
    • 6-Methyl-1H-pyrazolo[3,4-d]pyrimidin-4(7H)-one|CS-0152738
      30129-57-8

    References

    • Zhang, Xiaohong; Lin, Qiulian; Zhong, Ping Molecules, 2010 , vol. 15, # 5 p. 3079 - 3086
  • Route3

    References

    • Taylor, Edward C.; Patel, Hemantkumar H. Tetrahedron, 1992 , vol. 48, # 37 p. 8089 - 8100

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07,GHS09
Signal Word : Warning
UN#: 3077
Class : 9
Packing Group : Ⅲ
Hazard Statements : H317-H410
Precautionary Statements : P261-P272-P273-P280-P302+P352-P362+P364-P391-P501

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Computational Chemistry Data

  • TPSA   74.43
  • LogP   -0.04538
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   0

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