- Synthesis and characterization of physicochemical properties of hydrophilic imidazolium-based ionic liquidsYousefi, Maryam; Abdouss, Majid; Miran Beigi, Ali Akbar; Naseri, Ali, Korean Journal of Chemical Engineering, 2017, 34(9), 2527-2535
Cas no 178631-03-3 (1H-Imidazolium, 1-methyl-3-octyl-)
178631-03-3 structure
Product Name:1H-Imidazolium, 1-methyl-3-octyl-
CAS No:178631-03-3
MF:C12H25N2
MW:197.340303182602
CID:1366441
PubChem ID:22301571
Update Time:2025-04-20
1H-Imidazolium, 1-methyl-3-octyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazolium, 1-methyl-3-octyl-
- 1-methyl-3-octyl-1,2-dihydroimidazol-1-ium
- 178631-03-3
- 1-methyl-3-octyl-2,3-dihydro-1H-imidazol-1-ium
- AKOS028109987
-
- Inchi: 1S/C12H24N2/c1-3-4-5-6-7-8-9-14-11-10-13(2)12-14/h10-11H,3-9,12H2,1-2H3/p+1
- InChI Key: KTUWFYALZIAAGE-UHFFFAOYSA-O
- SMILES: N1(C=C[NH+](C)C1)CCCCCCCC
Computed Properties
- Exact Mass: 197.20195
- Monoisotopic Mass: 197.201773806g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 7
- Complexity: 166
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4
- Topological Polar Surface Area: 7.7?2
Experimental Properties
- PSA: 7.68
1H-Imidazolium, 1-methyl-3-octyl- Production Method
Production Method 1
Reaction Conditions
1.1 Reagents: Phosphoric acid Solvents: Water
Reference
Production Method 2
Reaction Conditions
1.1 24 h, 70 °C
Reference
- A silver and water free metathesis reaction: a route to ionic liquidsSrour, Hassan; Rouault, Helene; Santini, Catherine C.; Chauvin, Yves, Green Chemistry, 2013, 15(5), 1341-1347
Production Method 3
Reaction Conditions
1.1 Solvents: Water
Reference
- A kinetics study of copper-catalysed click reactions in ionic liquidsSloboda, Diana; Weber, Cameron C.; Bakis, Eduards, Organic & Biomolecular Chemistry, 2023, 21(39), 7984-7993
Production Method 4
Reaction Conditions
Reference
- The physical significance of the Kamlet-Taft π* parameter of ionic liquidsWeiss, Nadine; Schmidt, Caroline H.; Thielemann, Gabi; Heid, Esther; Schroeder, Christian; et al, Physical Chemistry Chemical Physics, 2021, 23(2), 1616-1626
Production Method 5
Reaction Conditions
1.1 Reagents: Phosphoric acid
Reference
- Synthesis of ethyl acetate catalyzed by imidazolium ionic liquidsTang, Xiao-li; Wang, Shao-jun; Wei, Li; Ma, Ying-chong; Guo, Yin, Dalian Qinggongye Xueyuan Xuebao, 2007, 26(2), 140-142
Production Method 6
Reaction Conditions
1.1 Solvents: Acetone ; 20 h, rt; 1 d, -20 °C
Reference
- Improvement in the separation efficiency of transesterification reaction compounds by the use of supported ionic liquid membranes based on the dicyanamide anionHernandez-Fernandez, Francisco J.; de los Rios, Antonia P.; Tomas-Alonso, Francisca; Gomez, Demetrio; Villora, Gloria, Desalination, 2009, 244(1-3), 122-129
Production Method 7
Reaction Conditions
1.1 Solvents: Acetone ; 20 h, rt; 1 d, -20 °C
Reference
- The effect of ionic liquid media on activity, selectivity and stability of Candida antarctica lipase B in transesterification reactionsDe Los Rios, Antonia P.; Hernandez-Fernandez, Francisco J.; Martinez, Francisco A.; Rubio, Manuel; Villora, Gloria, Biocatalysis and Biotransformation, 2007, 25(2-4), 151-156
Production Method 8
Reaction Conditions
1.1 Solvents: Acetonitrile ; 4 h, rt
Reference
- Synthesis and roperties of seven ionic liquids containing 1-methyl-3-octylimidazolium or 1-butyl-4-methylpyridinium cationsPapaiconomou, Nicolas; Yakelis, Neal; Salminen, Justin; Bergman, Robert; Prausnitz, John M., Journal of Chemical & Engineering Data, 2006, 51(4), 1389-1393
Production Method 9
Reaction Conditions
Reference
Reactivity of anionic nucleophiles in ionic liquids and molecular solvents
Betti, Cecilia;
Landini, Dario;
Maia, Angelamaria,
Tetrahedron,
2008,
64(8),
1689-1695
1H-Imidazolium, 1-methyl-3-octyl- Raw materials
- 1-Methyl-3-octylimidazolium Bromide
- N-Cyanocyanamide Sodium Salt
- 1-Methyl-3-octylimidazolium chloride
1H-Imidazolium, 1-methyl-3-octyl- Preparation Products
1H-Imidazolium, 1-methyl-3-octyl- Related Literature
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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