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CS-W001157 4
Total: USD 88.00

5,7-Difluorochroman-4-one

  • CAS No. 844648-22-2

  • Cat. No. CS-0097959
  • Purity≥97%
  • MDL No.MFCD11518474

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

5,7-Difluorochroman-4-one|CS-0097959

Structure of 844648-22-2

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General Information

  • CAS No. 844648-22-2
  • Cat. No. CS-0097959
  • Purity ≥97%
  • MDL No. MFCD11518474
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₆F₂O₂
  • Molecular Weight 184.14
  • Synonym(s) Tegoprazan Impurity 10
  • SMILES O=C1CCOC2=C1C(F)=CC(F)=C2

Synthesis

  • Route1
    • 3-(3,5-Difluorophenoxy)propanoic acid|CS-0131788
      844648-19-7
    • ~83%
    • In-stock
      5,7-Difluorochroman-4-one|CS-0097959
      844648-22-2

    References

    • NYCOMED GMBH Patent: WO2008/151927 A2, 2008 ; Location in patent: Page/Page column 61 ;
  • Route2
    • Methyl 3-(3,5-difluorophenoxy)propanoate|CS-0131789
      942195-90-6
    • ~87%
    • In-stock
      5,7-Difluorochroman-4-one|CS-0097959
      844648-22-2

    References

    • Pfizer Inc. Patent: US2007/142448 A1, 2007 ; Location in patent: Page/Page column 33 ;

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   26.3
  • LogP   1.93
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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