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CS-W001157 4
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3-Ethyl-1-methyl-1H-imidazol-3-ium trifluoromethanesulfonate

  • CAS No. 145022-44-2

  • Cat. No. CS-W012510
  • Molecule weight260.23
  • Purity≥98%
  • MDL No.MFCD00210008

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

3-Ethyl-1-methyl-1H-imidazol-3-ium trifluoromethanesulfonate|CS-W012510

Structure of 145022-44-2

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General Information

  • CAS No. 145022-44-2
  • Cat. No. CS-W012510
  • Purity ≥98%
  • MDL No. MFCD00210008
  • Storage Store at room temperature, keep dry and cool
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₁F₃N₂O₃S
  • Molecular Weight 260.23
  • Synonym(s) 1-ETHYL-3-METHYLIMIDAZOLIUM TRIFLUOROMETHYLSULFONATE
  • SMILES CN1C=C[N+](CC)=C1.O=S(C(F)(F)F)([O-])=O

Description

The following Baran Sulfinate is a part of a toolbox of diversification reagents, which are ideal for the late-stage functionalization of nitrogen-containing heterocycles. The regioselectivity can be effectively tuned by modification of the pH and solvent selection.

Synthesis

  • Route1
    • In-stock
      1-Ethyl-1H-imidazole|CS-W011340
      7098-07-9
    • null|null
      333-27-7
    • ~99%
    • In-stock
      3-Ethyl-1-methyl-1H-imidazol-3-ium trifluoromethanesulfonate|CS-W012510
      145022-44-2

    References

    • Kylloenen, Lasse; Parviainen, Arno; Deb, Somdatta; Lawoko, Martin; Gorlov, Mikhail; Kilpelaeinen, Ilkka; King, Alistair W. T. Green Chemistry, 2013 , vol. 15, # 9 p. 2374 - 2378
  • Route2
    • In-stock
      1-Methylimidazole|CS-W008580
      616-47-7
    • null|null
      425-75-2
    • ~97%
    • In-stock
      3-Ethyl-1-methyl-1H-imidazol-3-ium trifluoromethanesulfonate|CS-W012510
      145022-44-2

    References

    • Ignat'ev, Nikolai V.; Barthen, Peter; Kucheryna, Andryi; Willner, Helge; Sartori, Peter Molecules, 2012 , vol. 17, # 5 p. 5319 - 5338
  • Route3

    References

    • Synthetic Communications, , vol. 40, # 9 p. 1322 - 1332

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-H332-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   66.01
  • LogP   0.3839
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   1

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