5-Chloro-1-methylimidazole

Base Information

Chemical Name:5-Chloro-1-methylimidazole
CAS No.:872-49-1
Molecular Formula:C4H5ClN2
Molecular Weight:116.55
Hs Code.:2933290090
European Community (EC) Number:212-827-6
DSSTox Substance ID:DTXSID50236175
Nikkaji Number:J26.568C
Wikidata:Q72454071
Mol file:872-49-1.mol

Synonyms:5-Chloro-1-methylimidazole;872-49-1;5-Chloro-1-methyl-1H-imidazole;1-Methyl-5-chloroimidazole;1H-Imidazole, 5-chloro-1-methyl-;C4H5ClN2;EINECS 212-827-6;MFCD00014505;5-Chloro-1-Methylimidazole,98%;SCHEMBL1132866;DTXSID50236175;5-Chloro-1-methylimidazole, 98%;5-Chloro-1-methyl-1H-imidazole #;STK505483;AKOS001284087;AM804452;AS-14596;SY041529;BB 0254715;C2317;CS-0151157;FT-0620217;EN300-24053;W10455;A842051;AA-516/30012007;Z168874650

Suppliers and Price of 5-Chloro-1-methylimidazole

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

Usbiological
5-Chloro-1-methylimidazole-13C4
1mg
$ 531.00

TRC
5-Chloro-1-methylimidazole
20g
$ 1095.00

TRC
5-Chloro-1-methylimidazole
10g
$ 570.00

TRC
5-Chloro-1-methylimidazole
5g
$ 295.00

TRC
5-Chloro-1-methylimidazole
1g
$ 75.00

TCI Chemical
5-Chloro-1-methylimidazole >98.0%(GC)(T)
5g
$ 45.00

TCI Chemical
5-Chloro-1-methylimidazole >98.0%(GC)(T)
25g
$ 224.00

SynQuest Laboratories
5-Chloro-1-methylimidazole
5 g
$ 472.00

SynQuest Laboratories
5-Chloro-1-methylimidazole
250 mg
$ 80.00

SynQuest Laboratories
5-Chloro-1-methylimidazole
1 g
$ 152.00

Total 83 raw suppliers

Chemical Property of 5-Chloro-1-methylimidazole

Chemical Property:

Appearance/Colour:pale yellow oil
Vapor Pressure:0.33mmHg at 25°C
Melting Point:82-85 °C(11 mmHg)
Refractive Index:n20/D 1.511(lit.)
Boiling Point:207.1 °C at 760 mmHg
PKA:5.31±0.10(Predicted)
Flash Point:96.1 °C
PSA：17.82000
Density:1.26 g/cm³
LogP:1.07350
Storage Temp.:Sealed in dry,Room Temperature
Solubility.:Soluble in chloroform and insoluble in water
Water Solubility.:insoluble
XLogP3:1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:116.0141259
Heavy Atom Count:7
Complexity:66.7

Purity/Quality:

99% ^*data from raw suppliers

5-Chloro-1-methylimidazole-13C4 ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CN1C=NC=C1Cl
Uses 5-Chloro-1-methylimidazole is a labelled useful synthetic intermediate.

Technology Process of 5-Chloro-1-methylimidazole

There total 7 articles about 5-Chloro-1-methylimidazole 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: 96.0%

: 616-47-7
1-methyl-1H-imidazole

: 872-49-1
N-methyl-5-chloroimidazole

Guidance literature:: With N-chloro-N-(benzenesulfonyl)benzenesulfonamide; In acetonitrile; at 0 ℃; for 0.25h; Green chemistry;
DOI:10.1016/j.tetlet.2020.152689

Reference yield: 95.0%

: 615-35-0
N,N'-dimethyloxamide

: 872-49-1
N-methyl-5-chloroimidazole

Guidance literature:: With phosphorus pentachloride; trichlorophosphate; 1.) 100 deg C, 45min; 2.) 92 deg C, 75min;

Reference yield: 69.0%

: 15965-31-8
4-chloro-1H-imidazole

: 74-88-4
methyl iodide

: 872-49-1
N-methyl-5-chloroimidazole

Guidance literature:: 4-chloro-1H-imidazole; With methylmagnesium chloride; In tetrahydrofuran; at 20 ℃; for 0.5h; Inert atmosphere;

methyl iodide; In tetrahydrofuran; at 70 ℃; for 20h; Inert atmosphere;
DOI:10.1021/acs.orglett.5b02994