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CS-W001157 4
Total: USD 88.00

CK1-IN-5

  • CAS No. 1000340-33-9

  • Cat. No. CS-0004606
  • Purity≥98%
  • MDL No.MFCD09880122

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

CK1-IN-5|CS-0004606

Structure of 1000340-33-9

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General Information

  • CAS No. 1000340-33-9
  • Cat. No. CS-0004606
  • Purity ≥98%
  • MDL No. MFCD09880122
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄Br₂N₂
  • Molecular Weight 275.93
  • Synonym(s) None
  • SMILES BrC1=CNC2=NC=CC(Br)=C21

Synthesis

  • Route1

    References

    • GLAXO WELLCOME MANUFACTURING PTE LTD; CHEN, Deborah, W.; DUNCAN, Sarah; KING, Nigel, Paul; LEE, Kiew, Ching; MAK, Sing, Yeung; RIVERS, Dean, Andrews Patent: WO2012/170752 A1, 2012 ; Location in patent: Page/Page column 29 ; WO 2012/170752 A1
  • Route2

    References

    • BOEHRINGER INGELHEIM INTERNATIONAL GMBH; BOEHRINGER INGELHEIM PHARMA GMBH and CO. KG Patent: WO2009/126675 A1, 2009 ; Location in patent: Page/Page column 128-129 ; WO 2009/126675 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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   28.68
  • LogP   3.0879
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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