3,4,4-Trimethyl-1-(4-methylphenyl)sulfonyl-1,5-dihydroimidazole-1,3-diium;iodide

Base Information

Chemical Name:3,4,4-Trimethyl-1-(4-methylphenyl)sulfonyl-1,5-dihydroimidazole-1,3-diium;iodide
CAS No.:71254-91-6
Molecular Formula:C13H19 N2 O2 S . I
Molecular Weight:394.277
Hs Code.:2933290090
DSSTox Substance ID:DTXSID70697628
Mol file:71254-91-6.mol

Synonyms:3,4,4-trimethyl-1-(4-methylphenyl)sulfonyl-1,5-dihydroimidazole-1,3-diium;iodide;DTXSID70697628;PUBCHEM_53420408

Suppliers and Price of 3,4,4-Trimethyl-1-(4-methylphenyl)sulfonyl-1,5-dihydroimidazole-1,3-diium;iodide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
1-(PARA-TOSYL)-3,4,4-TRIMETHYL-2-IMIDAZOLINIUM IODIDE 98.00%
100G
$ 2829.75

Total 7 raw suppliers

Chemical Property of 3,4,4-Trimethyl-1-(4-methylphenyl)sulfonyl-1,5-dihydroimidazole-1,3-diium;iodide

Chemical Property:

Melting Point:178-181 °C(lit.)
PSA：48.77000
LogP:-0.57000
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:395.02902
Heavy Atom Count:19
Complexity:440

Purity/Quality:

98%Min ^*data from raw suppliers

1-(PARA-TOSYL)-3,4,4-TRIMETHYL-2-IMIDAZOLINIUM IODIDE 98.00% ^*data from reagent suppliers

Safty Information:

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

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=C(C=C1)S(=O)(=O)[NH+]2CC([N+](=C2)C)(C)C.[I-]

Technology Process of 3,4,4-Trimethyl-1-(4-methylphenyl)sulfonyl-1,5-dihydroimidazole-1,3-diium;iodide

There total 3 articles about 3,4,4-Trimethyl-1-(4-methylphenyl)sulfonyl-1,5-dihydroimidazole-1,3-diium;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: 76.0%

: 71254-89-2
1-p-toluenesulfonyl-4,4-dimethyl-Δ²-imidazoline

: 74-88-4
methyl iodide

: 71254-91-6
1-tosyl-3,4,4-trimethyl-Δ²-imidazolinium iodide

Guidance literature:: In dichloromethane; Heating;
DOI:10.1016/S0040-4020(01)90903-2

Reference yield:

: 2305-59-1
4,4-dimethyl-2-imidazoline

: 71254-91-6
1-tosyl-3,4,4-trimethyl-Δ²-imidazolinium iodide

Guidance literature:: Multi-step reaction with 2 steps

1: 94 percent / triethylamine / CH₂Cl₂ / 0 deg C, then warming to RT, 1 h

2: 76 percent / CH₂Cl₂ / Heating

With triethylamine; In dichloromethane;
DOI:10.1016/S0040-4020(01)90903-2

Reference yield:

: 98-59-9
p-toluenesulfonyl chloride

: 71254-91-6
1-tosyl-3,4,4-trimethyl-Δ²-imidazolinium iodide

Guidance literature:: Multi-step reaction with 2 steps

1: 94 percent / triethylamine / CH₂Cl₂ / 0 deg C, then warming to RT, 1 h

2: 76 percent / CH₂Cl₂ / Heating

With triethylamine; In dichloromethane;
DOI:10.1016/S0040-4020(01)90903-2