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(S)-ethyl 2-(tert-butoxycarbonylamino)-3-(4-nitrophenyl)propanoate

  • CAS No. 67630-00-6

  • Cat. No. CS-M0207
  • Molecule weight338.36
  • Purity≥98%
  • MDL No.MFCD18207035

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

(S)-ethyl 2-(tert-butoxycarbonylamino)-3-(4-nitrophenyl)propanoate|CS-M0207

Structure of 67630-00-6

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General Information

  • CAS No. 67630-00-6
  • Cat. No. CS-M0207
  • Purity ≥98%
  • MDL No. MFCD18207035
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₂₂N₂O₆
  • Molecular Weight 338.36
  • Synonym(s) (S)-3-(4-azido-phenyl)-2-tert-butoxycarbonylamino-propionic acid
  • SMILES O=C(OCC)[C@@H](NC(OC(C)(C)C)=O)CC(C=C1)=CC=C1[N+]([O-])=O

Synthesis

  • Route1

    References

    • MERCK and CO., INC. Patent: WO2006/115918 A2, 2006 ; Location in patent: Page/Page column 17-18 ;
  • Route2

    References

    • Kupczyk-Subotkowska, Lidia; Siahaan, Teruna J.; Basile, Anthony S.; Friedman, Henry S.; Higgins, Patricia E.; Song, Di; Gallo, James M. Journal of Medicinal Chemistry, 1997 , vol. 40, # 11 p. 1726 - 1730
  • Route3
    • null|null
      64-17-5
    • In-stock
      (S)-2-((tert-Butoxycarbonyl)amino)-3-(4-nitrophenyl)propanoic acid|CS-W007679
      33305-77-0
    • ~%
    • In-stock
      (S)-ethyl 2-(tert-butoxycarbonylamino)-3-(4-nitrophenyl)propanoate|CS-M0207
      67630-00-6

    References

    • Ajinomoto Co., Inc. Patent: EP1454898 A1, 2004 ; Location in patent: Page 39; 40 ;

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-P280-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   107.77
  • LogP   2.5937
  • H_Acceptors   6
  • H_Donors   1
  • Rotatable_Bonds   6

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