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CS-W001157 4
Total: USD 88.00

5-(Trifluoromethyl)uracil

  • CAS No. 54-20-6

  • Cat. No. CS-W019389
  • Molecule weight180.09
  • Purity≥97%
  • MDL No.MFCD00006024

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

5-(Trifluoromethyl)uracil|CS-W019389

Structure of 54-20-6

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General Information

  • CAS No. 54-20-6
  • Cat. No. CS-W019389
  • Purity ≥97%
  • MDL No. MFCD00006024
  • Storage -20°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₃F₃N₂O₂
  • Molecular Weight 180.09
  • Synonym(s) Trifluorothymine
  • SMILES O=C(N1)NC=C(C(F)(F)F)C1=O

Synthesis

  • Route1
    • null|null
      2314-97-8
    • Uracil Fluorouracil Impurity|CS-0229732
      66-22-8
    • ~91%
    • In-stock
      5-(Trifluoromethyl)uracil|CS-W019389
      54-20-6

    References

    • Tosoh Corporation; Tosoh F- Tech Inc.; SAGAMI CHEMICAL RESEARCH CENTER Patent: EP1947092 A1, 2008 ; Location in patent: Page/Page column 36; 37 ;
  • Route2

    References

    • US2014/135497 A1, ; Paragraph 0055; 0056; 0057; 0058; 0059 ;
  • Route3
    • 2,4-Difluoro-5-(trifluoromethyl)pyrimidine|CS-0651173
      153600-17-0
    • ~93%
    • In-stock
      5-(Trifluoromethyl)uracil|CS-W019389
      54-20-6

    References

    • Andres, Peter; Marhold, Albrecht Journal of Fluorine Chemistry, 1996 , vol. 77, # 1 p. 93 - 95

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   65.72
  • LogP   0.082
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   0

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