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CS-W001157 4
Total: USD 88.00

4-Chloro-3-methyl-1H-pyrazolo[3,4-d]pyrimidine

  • CAS No. 871335-85-2

  • Cat. No. CS-0050926
  • Purity≥97%
  • MDL No.None

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

4-Chloro-3-methyl-1H-pyrazolo[3,4-d]pyrimidine|CS-0050926

Structure of 871335-85-2

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General Information

  • CAS No. 871335-85-2
  • Cat. No. CS-0050926
  • Purity ≥97%
  • MDL No. None
  • Storage -20°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₅ClN₄
  • Molecular Weight 168.58
  • Synonym(s) None
  • SMILES CC1=NNC2=C1C(Cl)=NC=N2

Synthesis

  • Route1

    References

    • PFIZER PRODUCTS INC. Patent: WO2008/12635 A2, 2008 ; Location in patent: Page/Page column 84 ;
  • Route2
    • 3-Methyl-1h-pyrazolo[3,4-d]pyrimidin-4-ol|CS-0214868
      2942-47-4
    • ~42%
    • 4-Chloro-3-methyl-1H-pyrazolo[3,4-d]pyrimidine|CS-0050926
      871335-85-2

    References

    • EXELIXIS, INC. Patent: WO2005/117909 A2, 2005 ; Location in patent: Page/Page column 57 ; WO 2005/117909 A2
  • Route3

    References

    • Sunesis Pharmaceuticals, Inc Patent: US2009/5359 A1, 2009 ; Location in patent: Page/Page column 19 ; US 20090005359 A1

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   54.46
  • LogP   1.31472
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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