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CS-W001157 4
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2-((tert-Butoxycarbonyl)amino)-2-(3-(trifluoromethyl)phenyl)aceticacid

  • CAS No. 146621-92-3

  • Cat. No. CS-0171869
  • Purity≥97%
  • MDL No.MFCD07388839

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

2-((tert-Butoxycarbonyl)amino)-2-(3-(trifluoromethyl)phenyl)aceticacid|CS-0171869

Structure of 146621-92-3

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General Information

  • CAS No. 146621-92-3
  • Cat. No. CS-0171869
  • Purity ≥97%
  • MDL No. MFCD07388839
  • Storage 4°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₆F₃NO₄
  • Molecular Weight 319.28
  • Synonym(s) N-BOC-2-(3-TRIFLUOROMETHYL-PHENYL)-DL-GLYCINE
  • SMILES CC(C)(OC(NC(C(O)=O)C1=CC(C(F)(F)F)=CC=C1)=O)C

Synthesis

  • Route1
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      82425-18-1
    • ~%
    • In-stock
      2-((tert-Butoxycarbonyl)amino)-2-(3-(trifluoromethyl)phenyl)aceticacid|CS-0171869
      146621-92-3

    References

    • Shuman; Rothenberger; Campbell; Smith; Gifford-Moore; Gesellchen Journal of Medicinal Chemistry, 1993 , vol. 36, # 3 p. 314 - 319
  • Route2

    References

    • Shuman; Rothenberger; Campbell; Smith; Gifford-Moore; Gesellchen Journal of Medicinal Chemistry, 1993 , vol. 36, # 3 p. 314 - 319
  • Route3

    References

    • Shuman; Rothenberger; Campbell; Smith; Gifford-Moore; Gesellchen Journal of Medicinal Chemistry, 1993 , vol. 36, # 3 p. 314 - 319

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   75.63
  • LogP   3.3558
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   3

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