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CS-W001157 4
Total: USD 88.00

2,2,2-Trifluoro-1-(1H-imidazol-1-yl)ethanone

  • CAS No. 1546-79-8

  • Cat. No. CS-W013249
  • Purity≥97%
  • MDL No.MFCD00014501

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

2,2,2-Trifluoro-1-(1H-imidazol-1-yl)ethanone|CS-W013249

Structure of 1546-79-8

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General Information

  • CAS No. 1546-79-8
  • Cat. No. CS-W013249
  • Purity ≥97%
  • MDL No. MFCD00014501
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₃F₃N₂O
  • Molecular Weight 164.09
  • Synonym(s) ferric trifluoride trihydrate
  • SMILES FC(F)(F)C(N1C=CN=C1)=O

Description

1-(Trifluoroacetyl)imidazole (N-(Trifluroroacetyl)imidazole) is an effective reagent for specific trifluoroacetylation of an aminomethyl side chain of certain nucleosides.1-(Trifluoroacetyl)imidazole may be employed as derivatization reagent for the detection of mustard gas degradation products, thiodiglycol and thiodiglycol sulfoxide using gas chromatography-tandem mass spectrometry. It may be used as reagent for the trifluoroacetylation of amines. It was used for derivatization of ethanolamine phospholipid-alkenal Michael adducts for GC-MS analysis. It was used in the determination of quinolinic acid, a kynurenine metabolite, by GC/MS.

Synthesis

  • Route1
    • Imidazole Ondansetron Impurity|CS-0229601
      288-32-4
    • null|null
      407-25-0
    • ~%
    • In-stock
      2,2,2-Trifluoro-1-(1H-imidazol-1-yl)ethanone|CS-W013249
      1546-79-8

    References

    • Journal of Fluorine Chemistry, , vol. 127, # 12 p. 1564 - 1569
  • Route2
    • null|null
      530-62-1
    • null|null
      76-05-1
    • ~%
    • In-stock
      2,2,2-Trifluoro-1-(1H-imidazol-1-yl)ethanone|CS-W013249
      1546-79-8

    References

    • Journal of Fluorine Chemistry, , vol. 127, # 12 p. 1564 - 1569
  • Route3
    • null|null
      130451-27-3
    • null|null
      18156-74-6
    • ~%
    • null|null
      120240-10-0
    • In-stock
      2,2,2-Trifluoro-1-(1H-imidazol-1-yl)ethanone|CS-W013249
      1546-79-8

    References

    • Tetrahedron Letters, , vol. 31, # 28 p. 4081 - 4084

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02,GHS07
Signal Word : Danger
UN#: 1993
Class : 3
Packing Group : Ⅲ
Hazard Statements : H226-H315-H319-H335
Precautionary Statements : P210-P233-P240-P241-P242-P243-P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P370+P378-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   34.89
  • LogP   1.0856
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   0

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