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CS-W001157 4
Total: USD 88.00

1-Benzyl-3,3-difluoropiperidine-4,4-diol

  • CAS No. 1067914-81-1

  • Cat. No. CS-W007024
  • Molecule weightNone
  • Purity≥95%
  • MDL No.MFCD20926176

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

1-Benzyl-3,3-difluoropiperidine-4,4-diol|CS-W007024

Structure of 1067914-81-1

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General Information

  • CAS No. 1067914-81-1
  • Cat. No. CS-W007024
  • Purity ≥95%
  • MDL No. MFCD20926176
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₅F₂NO₂
  • Molecular Weight None
  • Synonym(s) None
  • SMILES OC1(O)C(F)(F)CN(CC2=CC=CC=C2)CC1

Synthesis

  • Route1
    • Ethyl 1-benzyl-5,5-difluoro-4-oxopiperidine-3-carboxylate|CS-W001287
      1067915-34-7
    • ~%
    • In-stock
      1-Benzyl-3,3-difluoropiperidine-4,4-diol|CS-W007024
      1067914-81-1

    References

    • ARRAY BIOPHARMA INC.; ALLEN, Shelley; CELESTE, Laura L.; DAVIS, T. Gregg; DELISLE, Robert Kirk; GRESCHUK, Julie Marie; GROSS, Stefan, D.; HICKEN, Erik, James; JACKSON, Leila, J.; LYSSIKATOS, Joseph, P.; KALLAN, Nicholas C.; MARMSATER, Fredrik, P.; MUNSON, Mark, C.; PHENEGER, Jed; RAST, Bryson; ROBINSON, John, E.; SCHLACHTER, Stephen T.; TOPALOV, George T.; WRIGHT, A. Dale; ZHAO, Qian Patent: WO2010/22076 A1, 2010 ; Location in patent: Page/Page column 114 ; WO 2010/022076 A1
  • Route2
    • Ethyl 3-(benzyl(3-ethoxy-3-oxopropyl)amino)-2,2-difluoropropanoate|CS-0326264
      851314-55-1
    • ~%
    • In-stock
      1-Benzyl-3,3-difluoropiperidine-4,4-diol|CS-W007024
      1067914-81-1

    References

    • GLAXOSMITHKLINE LLC; ADAMS, Nicholas, David; CHAUDHARI, Amita, M.; KIESOW, Terence, John; McSHERRY, Allison, K.; MOORE, Michael, Lee; PARRISH, Cynthia, Ann; REIF, Alexander, Joseph; RIDGERS, Lance, Howard Patent: WO2014/8223 A2, 2014 ;
  • Route3

    References

    • GLAXOSMITHKLINE LLC; ADAMS, Nicholas, David; CHAUDHARI, Amita, M.; KIESOW, Terence, John; McSHERRY, Allison, K.; MOORE, Michael, Lee; PARRISH, Cynthia, Ann; REIF, Alexander, Joseph; RIDGERS, Lance, Howard Patent: WO2014/8223 A2, 2014 ;

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 : P260-P264-P270-P271-P280-P301+P310-P302+P352-P304+P340-P305+P351+P338-P312-P330-P332+P313-P337+P313-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   43.7
  • LogP   1.2085
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   2

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