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CS-W001157 4
Total: USD 88.00

1-{5-Bromo-1H-pyrrolo[2,3-b]pyridin-3-yl}ethan-1-one

  • CAS No. 866545-96-2

  • Cat. No. CS-B0569
  • Purity≥98%
  • MDL No.MFCD12403936

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

1-{5-Bromo-1H-pyrrolo[2,3-b]pyridin-3-yl}ethan-1-one|CS-B0569

Structure of 866545-96-2

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General Information

  • CAS No. 866545-96-2
  • Cat. No. CS-B0569
  • Purity ≥98%
  • MDL No. MFCD12403936
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇BrN₂O
  • Molecular Weight 239.07
  • Synonym(s) 1-(5-Bromo-7-azaindole)ethanone
  • SMILES O=C(C)C1=CNC2=NC=C(Br)C=C12

Synthesis

  • Route1
    • null|null
      75-36-5
    • In-stock
      5-Bromo-7-azaindole|CS-B0096
      183208-35-7
    • ~10%
    • In-stock
      1-{5-Bromo-1H-pyrrolo[2,3-b]pyridin-3-yl}ethan-1-one|CS-B0569
      866545-96-2

    References

    • Hong, Seunghee; Lee, Soyoung; Kim, Bomi; Lee, Hyunseung; Hong, Soon-Sun; Hong, Sungwoo Bioorganic and Medicinal Chemistry Letters, 2010 , vol. 20, # 24 p. 7212 - 7215
  • Route2
    • null|null
      75-36-5
    • ~91%
    • In-stock
      1-{5-Bromo-1H-pyrrolo[2,3-b]pyridin-3-yl}ethan-1-one|CS-B0569
      866545-96-2

    References

    • VERTEX PHARMACEUTICALS INCORPORATED? Patent: WO2005/95400 A1, 2005 ; Location in patent: Page/Page column 330; 331 ; WO 2005/095400 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   45.75
  • LogP   2.528
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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