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1-Butyl-1-methylpyrrolidinium trifluoromethanesulfonate

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1-Butyl-1-methylpyrrolidinium trifluoromethanesulfonate Basic information

Product Name:
1-Butyl-1-methylpyrrolidinium trifluoromethanesulfonate
Synonyms:
  • [C4MPr]TfS
  • 1-BUTYL-METHYLPYRROLIDINIUM TRIFLUOROMETHANESULFONATE
  • N-butyl-N-MethylpyrrolidiniuM trifluoroacetate
  • N-butyl,methylpyrrolidinium trifluoroacetate
  • 1-Butyl-1-methylpyrrolidin-1-ium 2,2,2-trifluoroacetate
  • 1-butyl-1-methylpyrrolidin-1-ium:trifluoromethanesulfonate
  • BMPyrr OTf
  • PP1,4OTF
CAS:
367522-96-1
MF:
C10H20F3NO3S
MW:
291.3309096
Mol File:
367522-96-1.mol
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1-Butyl-1-methylpyrrolidinium trifluoromethanesulfonate Chemical Properties

Melting point:
4°C(lit.)
Density 
1.25 g/cm3 (20℃)
refractive index 
1.4320 to 1.4360
storage temp. 
Inert atmosphere,Room Temperature
form 
clear liquid
color 
Colorless to Light yellow to Light orange
PH
6 (H2O, 25℃)
BRN 
9820503
InChI
InChI=1S/C9H20N.CHF3O3S/c1-3-4-7-10(2)8-5-6-9-10;2-1(3,4)8(5,6)7/h3-9H2,1-2H3;(H,5,6,7)/q+1;/p-1
InChIKey
WZJDNKTZWIOOJE-UHFFFAOYSA-M
SMILES
S(=O)(=O)([O-])C(F)(F)F.[N+]1(CCCC1)(C)CCCC
ECW
4.2 V
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Safety Information

Hazard Codes 
Xi
Risk Statements 
36
Safety Statements 
26
WGK Germany 
3
HS Code 
2933 99 80
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1-Butyl-1-methylpyrrolidinium trifluoromethanesulfonate Usage And Synthesis

Conductivity

1.85 mS/cm (24 °C)

Uses

1-Butyl-1-methylpyrrolidinium trifluoromethanesulfonate ([BMPy][OTf]) is an ionic liquid that can be used as a solvent in:

  • Rhodium-catalyzed regioselective hydroformylation reactions.
  • Direct asymmetric aldol condensation reaction.
  • Desulfurization of fuels.
  • Nucleophilic aromatic substitution reactions.

([BMPy][OTf]) can also be used as an electrolyte in supercapacitor applications.

Preparation

First, the N, N'-butylmethylpyridinium chloride and potassium trifluoromethanesulfonate are mixed in acetone and reacted for 24 h.  The reaction solution is filtered to remove solid impurities. Finally, acetone in the solution is removed by distillation and purified to obtain 1-Butyl-1-methylpyrrolidinium trifluoromethanesulfonate.

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