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CS-W001157 4
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Benzyl 4-((tert-butoxycarbonyl)amino)piperidine-1-carboxylate

  • CAS No. 159874-20-1

  • Cat. No. CS-0333963
  • Purity95+%
  • MDL No.None

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

Benzyl 4-((tert-butoxycarbonyl)amino)piperidine-1-carboxylate|CS-0333963

Structure of 159874-20-1

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General Information

  • CAS No. 159874-20-1
  • Cat. No. CS-0333963
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₈H₂₆N₂O₄
  • Molecular Weight 334.41
  • Synonym(s) 1-Piperidinecarboxylic acid, 4-[[(1,1-dimethylethoxy)carbonyl]amino]-, phenylmethyl ester
  • SMILES CC(C)(OC(NC1CCN(C(OCC2=CC=CC=C2)=O)CC1)=O)C

Synthesis

  • Route1

    References

    • MERCK and CO., INC. Patent: WO2009/91856 A2, 2009 ; Location in patent: Page/Page column 63 ; WO 2009/091856 A2
  • Route2

    References

    • Zeneca Limited Patent: US5559131 A1, 1996 ; US 5559131 A
  • Route3

    References

    • Finke, Paul E.; Oates, Bryan; Mills, Sander G.; MacCoss, Malcolm; Malkowitz, Lorraine; Springer, Martin S.; Gould, Sandra L.; DeMartino, Julie A.; Carella, Anthony; Carver, Gwen; Holmes, Karen; Danzeisen, Renee; Hazuda, Daria; Kessler, Joseph; Lineberger, Janet; Miller, Michael; Schleif, William A.; Emini, Emilio A. Bioorganic and Medicinal Chemistry Letters, 2001 , vol. 11, # 18 p. 2475 - 2479

Safety Information

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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

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Computational Chemistry Data

  • TPSA   67.87
  • LogP   3.3123
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   3

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