2-(4-Fluorophenyl)-1-methyl-4-(trifluoromethyl)-1H-imidazole

Base Information

Chemical Name:2-(4-Fluorophenyl)-1-methyl-4-(trifluoromethyl)-1H-imidazole
CAS No.:33469-33-9
Molecular Formula:C₁₁H₈F₄N₂
Molecular Weight:244.192
Hs Code.:
DSSTox Substance ID:DTXSID70442817
Nikkaji Number:J849.038D
Wikidata:Q82260331

Synonyms:33469-33-9;2-(4-Fluorophenyl)-1-methyl-4-(trifluoromethyl)-1H-imidazole;DTXSID70442817;1H-Imidazole, 2-(4-fluorophenyl)-1-methyl-4-(trifluoromethyl)-

Suppliers and Price of 2-(4-Fluorophenyl)-1-methyl-4-(trifluoromethyl)-1H-imidazole

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
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Total 0 raw suppliers

Chemical Property of 2-(4-Fluorophenyl)-1-methyl-4-(trifluoromethyl)-1H-imidazole

Chemical Property:

Melting Point:86-87.2 °C
Boiling Point:305.8±52.0 °C(Predicted)
PSA：17.82000
Density:1.32±0.1 g/cm3(Predicted)
LogP:3.24500
XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:244.06236091
Heavy Atom Count:17
Complexity:261

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C=C(N=C1C2=CC=C(C=C2)F)C(F)(F)F

Technology Process of 2-(4-Fluorophenyl)-1-methyl-4-(trifluoromethyl)-1H-imidazole

There total 7 articles about 2-(4-Fluorophenyl)-1-methyl-4-(trifluoromethyl)-1H-imidazole 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: 45.0%

: 188397-75-3
2-(4-Fluoro-phenyl)-3-methyl-5,5-bis-trifluoromethyl-4,5-dihydro-3H-imidazol-4-ol

: 5-Fluoro-2-(4-fluoro-phenyl)-1-methyl-4-trifluoromethyl-1H-imidazole

: 33469-33-9
2-(4-fluorophenyl)-1-methyl-4-(trifluoromethyl)-4H-imidazol

Guidance literature:: With cesium fluoride; In dimethyl sulfoxide; at 120 ℃; for 2h;
DOI:10.1021/jo961723x

Reference yield: 13.0%

: 13435-20-6
tetraethylammoniumcyanide

: 188397-75-3
2-(4-Fluoro-phenyl)-3-methyl-5,5-bis-trifluoromethyl-4,5-dihydro-3H-imidazol-4-ol

: N-(2,2-Dicyano-1-trifluoromethyl-vinyl)-4-fluoro-N'-methyl-benzamidine

: 33469-33-9
2-(4-fluorophenyl)-1-methyl-4-(trifluoromethyl)-4H-imidazol

Guidance literature:: In dimethyl sulfoxide; at 70 ℃; for 2h;
DOI:10.1021/jo961723x

Reference yield:

: 49854-61-7
4-fluoro-N-<2,2,2-trifluoro-1-(trifluoromethyl)ethylidene>benzamide

: 33469-33-9
2-(4-fluorophenyl)-1-methyl-4-(trifluoromethyl)-4H-imidazol

Guidance literature:: Multi-step reaction with 4 steps

1: 2.) H₂O₂, NaOH / 1.)Et₂O, rt, overnight, 2.) MeOH, H₂O, rt, 2 h

2: 76 percent / NaH / dimethylformamide / 2 h

3: 100 percent / DIBAL-H / tetrahydrofuran / 2 h / Heating

4: 13 percent / dimethylsulfoxide / 2 h / 70 °C

With sodium hydroxide; dihydrogen peroxide; sodium hydride; diisobutylaluminium hydride; In tetrahydrofuran; dimethyl sulfoxide; N,N-dimethyl-formamide;
DOI:10.1021/jo961723x