1-Ethyl-2,3-dimethylimidazolium Bis(trifluoromethanesulfonyl)imide (CAS 174899-90-2)

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1-Ethyl-2,3-dimethylimidazolium Bis(trifluoromethanesulfonyl)imide. CAS 174899-90-2. 5g.

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Chemical Overview: 1-Ethyl-2,3-dimethylimidazolium Bis(trifluoromethanesulfonyl)imide
Molecular formulaC₉H₁₃F₆N₃O₄S₂[1]
Molecular weight405.3 g/mol[1]
IUPAC namebis(trifluoromethylsulfonyl)azanide;1-ethyl-2,3-dimethylimidazol-3-ium[1]
SMILESCCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F[1]
InChIKeyXDJYSDBSJWNTQT-UHFFFAOYSA-N[1]

Synonyms: 1-Ethyl-2,3-dimethylimidazolium Bis(trifluoromethanesulfonyl)imide · RefChem:432362 · 680-128-7 · 174899-90-2 · MFCD10566900

Data sources: PubChem (NLM/NIH)
Last updated: 2026-09-02

📚 Scientific references (Chicago Author-Date) (1 sources)
  1. PubChem. National Center for Biotechnology Information (NIH/NLM), chemical compound database. dotyczy: Molecular formula · Molecular weight · IUPAC name · SMILES · InChIKey

SCIENTIFIC RESEARCH

[1]CrossRef2026
Elena Graczova, Pavol Steltenpohl, Karel Řehák. (2026). "Binary and ternary liquid−liquid equilibrium for methylcyclohexane−m-xylene/p-xylene−1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)im
[2]CrossRef2026
Elena Graczova, Pavol Steltenpohl, Karel Řehák. (2026). "Binary and ternary liquid−liquid equilibrium for methylcyclohexane−m-xylene/p-xylene−1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)im
[3]CrossRef2024
Yanli Sun, Jingheng Zhu, Ruicheng Shi et al.. (2024). "Vapor–Liquid Equilibrium Experiment and Thermodynamic Correlation of Methyl Ethyl Carbonate + Ethanol + 1-Hexyl-3-methylimidazolium Bis(trifluoro
[4]CrossRef2023
Fabien Krebs, Oliver Höfft, Frank Endres. (2023). "Interaction of Aluminum and Platinum Surfaces with the Ionic Liquids 1-Butyl-1-methylpyrrolidinium bis(trifluoromethylsulfonyl)imide and 1-Ethyl-3-me
[5]CrossRef2023
Li-Chi Hung, Nai-Hsin Pan. (2023). "Thermal Safety of 1-Ethyl-3-Methylimidazolium Bis(trifluoromethylsulfonyl)imide for Construction-Related Safety Process". Processes. https://doi.org/10.3390/pr11102
[6]CrossRef2018
Anu Kadyan, Siddharth Pandey. (2018). "Lithium bis(trifluoromethylsulfonyl)imide-added ionic liquid 1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide mixture: Densities and dynamic viscosi
[7]CrossRef2016
Andreas Hofmann, Matthias Migeot, Lukas Arens et al.. (2016). "Investigation of Ternary Mixtures Containing 1-Ethyl-3-methylimidazolium Bis(trifluoromethanesulfonyl)azanide, Ethylene Carbonate and Lit
[8]CrossRef2008
Manuel Gamero-Castaño. (2008). "Characterization of the electrosprays of 1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl) imide in vacuum". Physics of Fluids. https://doi.org/10.1063/1.2899658
📚 Scientific references (Chicago Author-Date) 8 refs · 1 baz

MOLECULE Per-CAS bibliography (live from 13+ databases)

Sources: db:crossref (8)

  1. db:crossref Elena Graczova, Pavol Steltenpohl, Karel Řehák. (2026). "Binary and ternary liquid−liquid equilibrium for methylcyclohexane−m-xylene/p-xylene−1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide mixture". https://doi.org/10.2139/ssrn.6864538
  2. db:crossref Elena Graczova, Pavol Steltenpohl, Karel Řehák. (2026). "Binary and ternary liquid−liquid equilibrium for methylcyclohexane−m-xylene/p-xylene−1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide mixture". https://doi.org/10.2139/ssrn.7211173
  3. db:crossref Yanli Sun, Jingheng Zhu, Ruicheng Shi et al.. (2024). "Vapor–Liquid Equilibrium Experiment and Thermodynamic Correlation of Methyl Ethyl Carbonate + Ethanol + 1-Hexyl-3-methylimidazolium Bis(trifluoromethylsulfonyl)imide and 1-Ethyl-3-methylimidazolium Bis(trifluoromethylsulfonyl)imide at 101.3 kPa". Journal of Chemical & Engineering Data. https://doi.org/10.1021/acs.jced.4c00409
  4. db:crossref Li-Chi Hung, Nai-Hsin Pan. (2023). "Thermal Safety of 1-Ethyl-3-Methylimidazolium Bis(trifluoromethylsulfonyl)imide for Construction-Related Safety Process". Processes. https://doi.org/10.3390/pr11102966
  5. db:crossref Fabien Krebs, Oliver Höfft, Frank Endres. (2023). "Interaction of Aluminum and Platinum Surfaces with the Ionic Liquids 1-Butyl-1-methylpyrrolidinium bis(trifluoromethylsulfonyl)imide and 1-Ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide". Coatings. https://doi.org/10.3390/coatings13071182
  6. db:crossref Anu Kadyan, Siddharth Pandey. (2018). "Lithium bis(trifluoromethylsulfonyl)imide-added ionic liquid 1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide mixture: Densities and dynamic viscosities in the temperature range (298.15–358.15) K". The Journal of Chemical Thermodynamics. https://doi.org/10.1016/j.jct.2017.08.033
  7. db:crossref Andreas Hofmann, Matthias Migeot, Lukas Arens et al.. (2016). "Investigation of Ternary Mixtures Containing 1-Ethyl-3-methylimidazolium Bis(trifluoromethanesulfonyl)azanide, Ethylene Carbonate and Lithium Bis(trifluoromethanesulfonyl)azanide". International Journal of Molecular Sciences. https://doi.org/10.3390/ijms17050670
  8. db:crossref Manuel Gamero-Castaño. (2008). "Characterization of the electrosprays of 1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl) imide in vacuum". Physics of Fluids. https://doi.org/10.1063/1.2899658
Regulatory status of the substance
No entries for this CAS in the restriction lists checked (SVHC candidate list, REACH Annex XVII; datasets incomplete — this is not a confirmation of compliance). CLP classification and transport status (ADR): see the GHS section and the safety data sheet (SDS).
🧪 Chemical Data
CAS Number
174899-90-2
Molecular formula
C₉H₁₃F₆N₃O₄S₂
Molar mass
405.3 g/mol
IUPAC name (EN)
bis(trifluoromethylsulfonyl)azanide;1-ethyl-2,3-dimethylimidazol-3-ium
SMILES
CCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
InChIKey
XDJYSDBSJWNTQT-UHFFFAOYSA-N
🔍 External identifiers
6 of 16 ID systems38%
DatabaseIdentifierActions
CAS Registry Number174899-90-2Open →
PubChem CID21932259[1]Open →
InChIKeyXDJYSDBSJWNTQT-UHFFFAOYSA-N[1]Open →
InChIInChI=1S/C7H13N2.C2F6NO4S2/c1-4-9-6-5-8(3)7(9)2;…[1]
SMILESCCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(…[1]
ChEMBLCHEMBL3186724[2]Open →

Sources: PubChem (NIH), Wikidata SPARQL, KEGG, ChEMBL (EBI), CompTox CTX (EPA).

📚 Scientific references (Chicago Author-Date) (2 sources)
  1. PubChem. National Center for Biotechnology Information (NIH/NLM), chemical compound database. dotyczy: PubChem CID · InChIKey · InChI · SMILES
  2. ChEMBL. European Bioinformatics Institute (EMBL-EBI), bioactivity database. dotyczy: ChEMBL

Dalsza literatura

Publications topically related to this CAS. They are not the source of any value given on this card.

Extended Bibliography (5)

  1. ★★☆☆☆ CROSSREF 🔓 OPEN ❓ unverified Dhumal, Nilesh R., Damodaran, Krishnan. 2009. "Molecular interactions and normal vibrations of Fe–bis(trifluoromethanesulfonyl)imide and 1-ethyl-3-methylimidazolium–Fe–bis(trifluoromethanesulfonyl)imide ionic liquids: A density functional study." Journal of Molecular Structure: THEOCHEM 906 (1-3): 78-82. https://doi.org/10.1016/j.theochem.2009.04.009. link [accessed: 2026-09-02] CC0 (metadata)
  2. ★★☆☆☆ CROSSREF 🔓 OPEN ❓ unverified Anonymous. "Plastic Phase Transitions in N-Ethyl-N-methylpyrrolidinium Bis(trifluoromethanesulfonyl)imide.". https://doi.org/10.1021/cm051936f.s001. link [accessed: 2026-09-02] CC0 (metadata)
  3. ★★☆☆☆ CROSSREF 🔓 OPEN ❓ unverified Anonymous. "Liquid Structure of Room-Temperature Ionic Liquid, 1-Ethyl-3-methylimidazolium Bis-(trifluoromethanesulfonyl) Imide.". https://doi.org/10.1021/jp7105499.s002. link [accessed: 2026-09-02] CC0 (metadata)
  4. ★★☆☆☆ CROSSREF 🔓 OPEN ❓ unverified Anonymous. "SolidLiquid Equilibria Measurements of Mixtures of Lithium Bis(trifluoromethanesulfonyl)imide with Varying Alkyl Chain Length Ammonium Bis(trifluoromethanesulfonyl)imide Ionic Liquids.". https://doi.org/10.1021/acs.jced.5b00807.s001. link [accessed: 2026-09-02] CC0 (metadata)
  5. ★★☆☆☆ CROSSREF 🔓 OPEN ❓ unverified Anonymous. "Glyme-Lithium Bis(trifluoromethanesulfonyl)imide and Glyme-Lithium Bis(perfluoroethanesulfonyl)imide Phase Behavior and Solvate Structures.". https://doi.org/10.1021/cm047881j.s002. link [accessed: 2026-09-02] CC0 (metadata)

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1-Ethyl-2,3-dimethylimidazolium Bis(trifluoromethanesulfonyl)imide — CAS 174899-90-2, purity 0.98, 5g. Listed by Beijing Tong Guang. Prepared from the supplier’s public catalogue; not verified against their internal data.

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