CAS 174899-66-2 | 1-Butyl-3-methylimidazolium Trifluoromethanesulfonate | CAS Number 174899-66-2

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174899-66-2 | 1-Butyl-3-methylimidazolium Trifluoromethanesulfonate

CAS No: 174899-66-2 Catalog No: AG003E6H MDL No:MFCD03427620

Product Description

Catalog Number:

AG003E6H

Chemical Name:

1-Butyl-3-methylimidazolium Trifluoromethanesulfonate

CAS Number:

174899-66-2

Molecular Formula:

C9H15F3N2O3S

Molecular Weight:

288.2872

MDL Number:

MFCD03427620

IUPAC Name:

1-butyl-3-methylimidazol-3-ium;trifluoromethanesulfonate

InChI:

InChI=1S/C8H15N2.CHF3O3S/c1-3-4-5-10-7-6-9(2)8-10;2-1(3,4)8(5,6)7/h6-8H,3-5H2,1-2H3;(H,5,6,7)/q+1;/p-1

InChI Key:

FRZPYEHDSAQGAS-UHFFFAOYSA-M

SMILES:

[O-]S(=O)(=O)C(F)(F)F.CCCCn1cc[n+](c1)C

NSC Number:

746783

Properties

Complexity:

238

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

288.076g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

288.285g/mol

Monoisotopic Mass:

288.076g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

74.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

Literature

Title	Journal
Role of the Hofmeister series in the formation of ionic-liquid-based aqueous biphasic systems.	The journal of physical chemistry. B 20120621
Microwave-assisted separation of ionic liquids from aqueous solution of ionic liquids.	Journal of chromatography. A 20101203
Optimization of lipase-catalyzed glucose ester synthesis in ionic liquids.	Bioprocess and biosystems engineering 20100101
Anion configuration at the air/liquid interface of ionic liquid [bmim]OTf studied by sum-frequency generation spectroscopy.	The journal of physical chemistry. B 20080925
Temperature-programed time-of-flight secondary ion mass spectrometry study of 1-butyl-3-methylimidazolium trifluoromethanesulfonate during glass-liquid transition, crystallization, melting, and solvation.	The Journal of chemical physics 20080907