1-Butyl-3-methylimidazolium Iodide

Base Information

• Chemical Name: 1-Butyl-3-methylimidazolium Iodide
• CAS No.: 65039-05-6
• Molecular Formula: C8H15 N2 . I
• Molecular Weight: 266.125
• Hs Code.: 29332900
• European Community (EC) Number: 619-502-1
• ChEMBL ID: CHEMBL3182223
• DSSTox Substance ID: DTXSID7049342
• Metabolomics Workbench ID: 61599
• Mol file: 65039-05-6.mol

Synonyms:1-Butyl-3-methylimidazolium Iodide;65039-05-6;[bmim][I];1-butyl-3-methylimidazol-3-ium;iodide;1-butyl-3-methyl-1H-imidazol-3-ium iodide;DTXSID7049342;CHEBI:61335;N-butyl-N'-methylimidazolium iodide;MFCD08276307;[bmim]i;BMIMI;1-BUTYL-3-METHYLIMIDAZOLIUMIODIDE;SCHEMBL379731;CHEMBL3182223;DTXCID7029299;1-butyl-3-methyl-imidazolium iodide;Tox21_202618;AKOS015833238;AKOS025402733;CS-W012432;NCGC00260166-01;AS-61691;SY038952;1-Butyl-3-methylimidazolium iodide, 99%;CAS-65039-05-6;B2708;FT-0696745;D70794;A854286

Chemical Property of 1-Butyl-3-methylimidazolium Iodide

Chemical Property:

• Melting Point: -72.0 °C (decomp)
• PSA: 8.81000
• Density: 1.46 g/cm3(Temp: 25.1 °C)
• LogP: -1.88330
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 266.02800
• Heavy Atom Count: 11
• Complexity: 93.3

Purity/Quality:

99.0% ^*data from raw suppliers

1-Butyl-3-methylimidazolium Iodide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCN1C=C[N+](=C1)C.[I-]
• Uses: BMImI can be used as a non-volatile electrolyte in dye-sensitized photochemical cells. It can also be used as a stabilizer/promotor/reaction medium for the transition metal catalyzed biphasic oxidative cyclocarbonylation of β-aminoalcohols and 2-aminophenol to form the corresponding 2-oxazolidinones.

Technology Process of 1-Butyl-3-methylimidazolium Iodide

There total 6 articles about 1-Butyl-3-methylimidazolium Iodide 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: 98.0%

1-methyl-1H-imidazole (616-47-7) + 1-iodo-butane (542-69-8) → 1-methyl-3-(n-butyl)imidazolium iodide (65039-05-6)

Guidance literature:

at 165 ℃; for 0.166667h; Sealed tube; Inert atmosphere; Microwave irradiation;

DOI:10.1002/adsc.202000032

Reference yield: 98.0%

1-Butylimidazole (4316-42-1) + trimethyl orthoformate (149-73-5) → 1-methyl-3-(n-butyl)imidazolium iodide (65039-05-6)

Guidance literature:

With ammonium iodide; Schlenk technique; Reflux;

Reference yield: 98.0%

1-Butylimidazole (4316-42-1) + methyl iodide (74-88-4) → 1-methyl-3-(n-butyl)imidazolium iodide (65039-05-6)

Guidance literature:

at 50 ℃; for 24h; Inert atmosphere; neat (no solvent);

DOI:10.1039/b915743n

upstream raw materials:

1-methyl-1H-imidazole

1-iodo-butane

1-Butylimidazole

methyl iodide

Downstream raw materials:

1-butyl-3-methylimidazolium hydrogen sulfate

1-butyl-3-methylimidazolium chloride

3-butyl-1-methyl-1H-imidazol-3-ium hexafluorophosphate

1-butyl-3-methylimidazolium nitrate

Refernces

• 1、 Li, Shengke,Wyman, Ian W.,Wang, Chunming,Wang, Yitao,Macartney, Donal H.,Wang, Ruibing. "Inhibition of C(2)-H Activity on Alkylated Imidazolium Monocations and Dications upon Inclusion by Cucurbit[7]uril". . p. 9494 - 9498. Retrieved 2016.
• 2、 Li, Hong,Liu, Bing,Xu, Ling,Jiao, Huan. "A hetero-MOF-based bifunctional ratiometric fluorescent sensor for pH and water detection". . p. 143 - 150. Retrieved 2021.
• 3、 Grollier, Kevin,Vu, Nam Duc,Onida, Killian,Akhdar, Ayman,Norsic, Sébastien,D'Agosto, Franck,Boisson, Christophe,Duguet, Nicolas. "A Thermomorphic Polyethylene-Supported Imidazolium Salt for the Fixation of CO2 into Cyclic Carbonates". . p. 1696 - 1705. Retrieved 2020/03/19.