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CS-W001157 4
Total: USD 88.00

5-Bromo-1-isopropylpyridin-2(1H)-one

  • CAS No. 851087-08-6

  • Cat. No. CS-0187106
  • Purity≥98%
  • MDL No.None

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

5-Bromo-1-isopropylpyridin-2(1H)-one|CS-0187106

Structure of 851087-08-6

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General Information

  • CAS No. 851087-08-6
  • Cat. No. CS-0187106
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₀BrNO
  • Molecular Weight 216.08
  • Synonym(s) 5-bromo-1-propan-2-ylpyridin-2-one
  • SMILES CC(C)N1C=C(C=CC1=O)Br

Synthesis

  • Route1

    References

    • VERTEX PHARMACEUTICALS INCORPORATED; CHARRIER, Jean-Damien; BINCH, Haley, Marie; HURLEY, Dennis, James; CLEVELAND, Thomas; JOSHI, Pramod; FANNING, Lev Tyler, Dewey; PINDER, Joanne; O'DONNELL, Michael; VIRANI, Anisa, Nizarali; KNEGTEL, Ronald, Marcellus Alphonsus; DURRANT, Steven, John; YOUNG, Stephen, Clinton; PIERRE-HENRI; KAY, David; REAPER, Philip, Michael Patent: WO2011/143426 A1, 2011 ; Location in patent: Page/Page column 56-57 ; WO 2011/143426 A1
  • Route2

    References

    • WO2009/105500 A1, ; Page/Page column 218-219 ; WO 2009/105500 A1
  • Route3

    References

    • Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH Patent: US2010/331320 A1, 2010 ; Location in patent: Page/Page column 78 ;

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
Precautionary Statements : P264-P270-P280-P302+P352-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   22
  • LogP   2.1917
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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