1-Ethyl-2,3-dimethylimidazolium trifluoromethanesulfonate

Base Information

• Chemical Name: 1-Ethyl-2,3-dimethylimidazolium trifluoromethanesulfonate
• CAS No.: 174899-72-0
• Molecular Formula: C7H13N2.CF3O3S
• Molecular Weight: 274.26
• European Community (EC) Number: 623-746-4
• ChEMBL ID: CHEMBL3182216
• DSSTox Substance ID: DTXSID5049233
• Mol file: 174899-72-0.mol

Synonyms:174899-72-0;1-Ethyl-2,3-dimethylimidazolium trifluoromethanesulfonate;1-ethyl-2,3-dimethyl-1H-imidazol-3-ium trifluoromethanesulfonate;1-ethyl-2,3-dimethylimidazolium triflate;DTXSID5049233;1-ethyl-2,3-dimethylimidazol-3-ium;trifluoromethanesulfonate;SCHEMBL1330266;CHEMBL3182216;DTXCID7029089;HMAHVRVKBSHMJX-UHFFFAOYSA-M;Tox21_202637;MFCD07784438;AKOS025394455;NCGC00260185-01;CAS-174899-72-0;CS-0448640;1-Ethyl-2,3-methylimidazolium Trifluoromethanesulfonate;1-ethyl-2,3-dimethyl-1H-imidazol-3-iumtrifluoromethanesulfonate

Chemical Property of 1-Ethyl-2,3-dimethylimidazolium trifluoromethanesulfonate

Chemical Property:

• PSA: 74.39000
• LogP: 1.77310
• Sensitive.: Moisture Sensitive
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 274.05989794
• Heavy Atom Count: 17
• Complexity: 238

Purity/Quality:

98%,99%, ^*data from raw suppliers

1-Ethyl-2,3-dimethylimidazolium trifluoromethanesulfonate, 98% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[O-]

Technology Process of 1-Ethyl-2,3-dimethylimidazolium trifluoromethanesulfonate

There total 2 articles about 1-Ethyl-2,3-dimethylimidazolium trifluoromethanesulfonate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 80.0%

1,2-dimethyl-1H-imidazole (1739-84-0) + trifluoromethanesulfonic acid ethyl ester (425-75-2) → 1-ethyl-2,3-dimethylimidazolium trifluoromethanesulfonate (174899-72-0)

Guidance literature:

In 1,1,1-trichloroethane; 0 deg C; 75 deg C, 3 h; 25 deg C, 8 h;

DOI:10.1039/b107720a

Reference yield:

→ 1-ethyl-2,3-dimethylimidazolium trifluoromethanesulfonate (174899-72-0)

Guidance literature:

upstream raw materials:

1,2-dimethyl-1H-imidazole

trifluoromethanesulfonic acid ethyl ester