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CS-W001157 4
Total: USD 88.00

3-Hexyl-1-methyl-1H-imidazol-3-ium Bis((trifluoromethyl)sulfonyl)amide

  • CAS No. 382150-50-7

  • Cat. No. CS-0378390
  • Purity≥98%
  • MDL No.MFCD08458931

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

3-Hexyl-1-methyl-1H-imidazol-3-ium Bis((trifluoromethyl)sulfonyl)amide|CS-0378390

Structure of 382150-50-7

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General Information

  • CAS No. 382150-50-7
  • Cat. No. CS-0378390
  • Purity ≥98%
  • MDL No. MFCD08458931
  • Storage Store at room temperature, keep dry and cool
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₉F₆N₃O₄S₂
  • Molecular Weight 447.42
  • Synonym(s) 1-Hexyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide
  • SMILES O=S([N-]S(=O)(C(F)(F)F)=O)(C(F)(F)F)=O.CN1C=[N+](CCCCCC)C=C1

Application

3-Hexyl-1-methyl-1H-imidazol-3-ium bis((trifluoromethyl)sulfonyl)amide serves as a stable, low-melting-point ionic liquid with exceptional thermal and chemical robustness. It functions as a versatile solvent and catalyst support in transition metal-catalyzed cross-coupling reactions, enabling efficient transformations under mild conditions. Its broad functional group tolerance and ease of product separation make it ideal for iterative synthetic workflows in medicinal chemistry and process development.

Synthesis

  • Route1
    • In-stock
      1-Hexyl-3-methylimidazolium Bromide|CS-W009303
      85100-78-3
    • null|null
      90076-65-6
    • ~98%
    • In-stock
      3-Hexyl-1-methyl-1H-imidazol-3-ium Bis((trifluoromethyl)sulfonyl)amide|CS-0378390
      382150-50-7

    References

    • Weber, Cameron C.; Masters, Anthony F.; Maschmeyer, Thomas Angewandte Chemie - International Edition, 2012 , vol. 51, # 46 p. 11483 - 11486 Angew. Chem., 2012 , vol. 124, # 46 p. 11650 - 11654,5
  • Route2
    • null|null
      90076-65-6
    • In-stock
      1-Hexyl-3-methylimidazolium Chloride|CS-W015487
      171058-17-6
    • ~97%
    • In-stock
      3-Hexyl-1-methyl-1H-imidazol-3-ium Bis((trifluoromethyl)sulfonyl)amide|CS-0378390
      382150-50-7

    References

    • Watanabe, Yuta; Katsuta, Shoichi Journal of Chemical and Engineering Data, 2014 , vol. 59, # 3 p. 696 - 701
  • Route3
    • null|null
      111-25-1
    • ~%
    • In-stock
      3-Hexyl-1-methyl-1H-imidazol-3-ium Bis((trifluoromethyl)sulfonyl)amide|CS-0378390
      382150-50-7

    References

    • Luo, Huimin; Dai, Sheng; Bonnesen, Peter V. Analytical Chemistry, 2004 , vol. 76, # 10 p. 2773 - 2779

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

Quality Control

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Computational Chemistry Data

  • TPSA   91.19
  • LogP   2.9522
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   7

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