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CS-W001157 4
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Methyl 2-{[(tert-butoxy)carbonyl]amino}-3,3,3-trifluoropropanoate

  • CAS No. 1039356-94-9

  • Cat. No. CS-0246859
  • Purity≥97%
  • MDL No.None

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

Methyl 2-{[(tert-butoxy)carbonyl]amino}-3,3,3-trifluoropropanoate|CS-0246859

Structure of 1039356-94-9

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General Information

  • CAS No. 1039356-94-9
  • Cat. No. CS-0246859
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₄F₃NO₄
  • Molecular Weight 257.21
  • Synonym(s) (R)-Methyl 2-((tert-butoxycarbonyl)amino)-3,3,3-trifluoropropanoate
  • SMILES CC(C)(OC(NC(C(F)(F)F)C(OC)=O)=O)C

Synthesis

  • Route1

    References

    • F. HOFFMANN-LA ROCHE AG; HENDRICKS, Robert, Than; HERMANN, Johannes, Cornelius; JAIME-FIGUEROA, Saul; KONDRU, Rama, K.; LOU, Yan; LYNCH, Stephen, M.; OWENS, Timothy, D.; SOTH, Michael; YEE, Calvin, Wesley Patent: WO2011/144585 A1, 2011 ; Location in patent: Page/Page column 135 ; WO 2011/144585 A1

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   64.63
  • LogP   1.615
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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