2,2,2-trifluoro-1-(1-methyl-1H-imidazol-2-yl)ethanone

Base Information

Chemical Name:2,2,2-trifluoro-1-(1-methyl-1H-imidazol-2-yl)ethanone
CAS No.:62366-56-7
Molecular Formula:C6H5F3N2O
Molecular Weight:178.1119096
Hs Code.:2933290090
European Community (EC) Number:960-251-5
DSSTox Substance ID:DTXSID50489422
Nikkaji Number:J2.574.193E
Wikidata:Q82332708
Mol file:62366-56-7.mol

Synonyms:62366-56-7;2,2,2-trifluoro-1-(1-methyl-1H-imidazol-2-yl)ethanone;2,2,2-TRIFLUORO-1-(1-METHYLIMIDAZOL-2-YL)ETHANONE;2,2,2-trifluoro-1-(1-methyl-1H-imidazol-2-yl)ethan-1-one;DTXSID50489422;Ethanone, 2,2,2-trifluoro-1-(1-methyl-1H-imidazol-2-yl)-;Ethanone, 2,2,2-trifluoro-1-(1-methyl-1H-imidazol-2-yl)- (9CI);MFCD08166733;AKOS000268879;CS-0241069;EN300-23121;A934312;Z147651970

Suppliers and Price of 2,2,2-trifluoro-1-(1-methyl-1H-imidazol-2-yl)ethanone

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

TRC
2,2,2-Trifluoro-1-(1-methyl-1H-imidazol-2-yl)ethanone
50mg
$ 155.00

TRC
2,2,2-Trifluoro-1-(1-methyl-1H-imidazol-2-yl)ethanone
10mg
$ 45.00

Crysdot
2,2,2-Trifluoro-1-(1-methyl-1H-imidazol-2-yl)ethanone 97%
1g
$ 564.00

American Custom Chemicals Corporation
2,2,2-TRIFLUORO-1-(1-METHYL-1H-IMIDAZOL-2-YL)ETHANONE 95.00%
5G
$ 1928.08

American Custom Chemicals Corporation
2,2,2-TRIFLUORO-1-(1-METHYL-1H-IMIDAZOL-2-YL)ETHANONE 95.00%
2.5G
$ 1473.14

American Custom Chemicals Corporation
2,2,2-TRIFLUORO-1-(1-METHYL-1H-IMIDAZOL-2-YL)ETHANONE 95.00%
1G
$ 983.52

Total 6 raw suppliers

Chemical Property of 2,2,2-trifluoro-1-(1-methyl-1H-imidazol-2-yl)ethanone

Chemical Property:

Vapor Pressure:0.909mmHg at 25°C
Melting Point:56 °C
Boiling Point:180.15°C at 760 mmHg
PKA:1.78±0.25(Predicted)
Flash Point:62.753°C
PSA：34.89000
Density:1.407g/cm³
LogP:1.16510
XLogP3:1.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:178.03539727
Heavy Atom Count:12
Complexity:192

Purity/Quality:

99% ^*data from raw suppliers

2,2,2-Trifluoro-1-(1-methyl-1H-imidazol-2-yl)ethanone ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C=CN=C1C(=O)C(F)(F)F

Technology Process of 2,2,2-trifluoro-1-(1-methyl-1H-imidazol-2-yl)ethanone

There total 2 articles about 2,2,2-trifluoro-1-(1-methyl-1H-imidazol-2-yl)ethanone 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: 83.0%

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

: 407-25-0
trifluoroacetic anhydride

: 62366-56-7
2,2,2-trifluoro-1-(1-methyl-1H-imidazol-2-yl)ethanone oxime

Guidance literature:: With triethylamine; In toluene; at -20 ℃; Inert atmosphere;
DOI:10.1002/chem.201602372

Reference yield:

: 62366-56-7
2,2,2-trifluoro-1-(1-methyl-1H-imidazol-2-yl)ethanone oxime

Guidance literature:: 1-Methylimidazol, Trifluoracetylchlorid;

Reference yield: 99.0%

: 766-49-4
(2-fluorophenyl)acetylene

: 62366-56-7
2,2,2-trifluoro-1-(1-methyl-1H-imidazol-2-yl)ethanone oxime

: (R)-1,1,1-trifluoro-4-(2-fluorophenyl)-2-(1-methyl-1H-imidazol-2-yl)but-3-yn-2-ol

Guidance literature:: With C₄₀H₄₂N₄Rh⁽¹⁺⁾*F₆P^(1-); triethylamine; In tetrahydrofuran; at 40 ℃; for 15h; enantioselective reaction; Schlenk technique; Inert atmosphere; Sealed tube;
DOI:10.1002/chem.201602372