1-Octyl-3-methylimidazolium trifluoromethanesulfonate

CAS Registry Number®

403842-84-2
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CAS Name

1-Octyl-3-methylimidazolium trifluoromethanesulfonate

Molecular Formula

C12H23N2.CF3O3S

Cite this Page

1-Octyl-3-methylimidazolium trifluoromethanesulfonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=403842-84-2 (retrieved 2024-04-20) (CAS RN: 403842-84-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    5 °C
  • Density (1)

    1.12 g/cm³ @ Temp: 25 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H23N2.CHF3O3S/c1-3-4-5-6-7-8-9-14-11-10-13(2)12-14;2-1(3,4)8(5,6)7/h10-12H,3-9H2,1-2H3;(H,5,6,7)/q+1;/p-1

InChIKey

InChIKey=BCVMAYRUJBXMAP-UHFFFAOYSA-M

SMILES

C(CCCCCCC)[N+]1=CN(C)C=C1.C(S(=O)(=O)[O-])(F)(F)F

Canonical SMILES

O=S(=O)([O-])C(F)(F)F.C1=C[N+](=CN1C)CCCCCCCC

Other Names for this Substance

  • 1H-Imidazolium, 1-methyl-3-octyl-, 1,1,1-trifluoromethanesulfonate (1:1)
  • 1H-Imidazolium, 1-methyl-3-octyl-, salt with trifluoromethanesulfonic acid (1:1)
  • 1-Methyl-3-octyl-1H-imidazolium trifluoromethanesulfonate
  • 1-Octyl-3-methylimidazolium trifluoromethanesulfonate
  • 1-Methyl-3-octylimidazolium triflate

Deleted or Replaced CAS Registry Numbers

900797-94-6

CAS INSIGHTSTM
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