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CS-W001157 4
Total: USD 88.00

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

  • CAS No. 1082950-96-6

  • Cat. No. CS-B1698
  • Molecule weight280.45
  • Purity≥97%
  • MDL No.MFCD11559017

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

4-Chloro-3-iodo-1H-pyrazolo[3,4-d]pyrimidine|CS-B1698

Structure of 1082950-96-6

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General Information

  • CAS No. 1082950-96-6
  • Cat. No. CS-B1698
  • Purity ≥97%
  • MDL No. MFCD11559017
  • Storage -20°C, sealed storage, away from moisture and light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₂ClIN₄
  • Molecular Weight 280.45
  • Synonym(s) None
  • SMILES IC1=NNC2=NC=NC(Cl)=C21

Synthesis

  • Route1
    • 4-Chloro-1H-pyrazolo[3,4-d]pyrimidine|CS-D1776
      5399-92-8
    • ~61%
    • 4-Chloro-3-iodo-1H-pyrazolo[3,4-d]pyrimidine|CS-B1698
      1082950-96-6

    References

    • ELI LILLY AND COMPANY Patent: WO2008/140947 A1, 2008 ; Location in patent: Page/Page column 38 ; WO 2008/140947 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   1.6109
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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