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(S)-2-((tert-butoxycarbonyl)amino)-3-(1H-imidazol-1-yl)propanoic acid

  • CAS No. 122225-53-0

  • Cat. No. CS-0572689
  • Molecule weight255.27
  • Purity≥98%
  • MDL No.None

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

(S)-2-((tert-butoxycarbonyl)amino)-3-(1H-imidazol-1-yl)propanoic acid|CS-0572689

Structure of 122225-53-0

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General Information

  • CAS No. 122225-53-0
  • Cat. No. CS-0572689
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₇N₃O₄
  • Molecular Weight 255.27
  • Synonym(s) N-(tert-butoxycarbonyl)-3-imidazol-1-yl-L-alanine
  • SMILES CC(C)(C)OC(=O)N[C@@H](CN1C=CN=C1)C(=O)O

Synthesis

  • Route1

    References

    • Marsault, Eric; Fraser, Graeme L.; Benakli, Kamel; St-Louis, Carl; Rouillard, Alain; Thomas, Helmut Patent: US2010/93720 A1, 2010 ; Location in patent: Page/Page column 37 ; US 20100093720 A1
  • Route2

    References

    • Marsault, Eric; Benakli, Kamel; Beaubien, Sylvie; Saint-Louis, Carl; Deziel, Robert; Fraser, Graeme Bioorganic and Medicinal Chemistry Letters, 2007 , vol. 17, # 15 p. 4187 - 4190

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   93.45
  • LogP   0.861
  • H_Acceptors   5
  • H_Donors   2
  • Rotatable_Bonds   4

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