Acetamide, N-(3-(4-fluoro-3-trifluoromethylphenyl)-5,5-dimethyl-2-oxo-4-imidazolidinylidene)-

Base Information

• Chemical Name: Acetamide, N-(3-(4-fluoro-3-trifluoromethylphenyl)-5,5-dimethyl-2-oxo-4-imidazolidinylidene)-
• CAS No.: 92668-63-8
• Molecular Formula: C₁₄H₁₃F₄N₃O₂
• Molecular Weight: 331.27
• Mol file: 92668-63-8.mol

Synonyms:BRN 5617163;Acetamide, N-(3-(4-fluoro-3-trifluoromethylphenyl)-5,5-dimethyl-2-oxo-4-imidazolidinylidene)-;92668-63-8;Acetamide, N-(5,5-dimethyl-2-oxo-3-(alpha,alpha,alpha,4-tetrafluoro-m-tolyl)-4-imidazolidinylidene)-

Chemical Property of Acetamide, N-(3-(4-fluoro-3-trifluoromethylphenyl)-5,5-dimethyl-2-oxo-4-imidazolidinylidene)-

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 331.09438931
• Heavy Atom Count: 23
• Complexity: 545

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)N=C1C(NC(=O)N1C2=CC(=C(C=C2)F)C(F)(F)F)(C)C

Technology Process of Acetamide, N-(3-(4-fluoro-3-trifluoromethylphenyl)-5,5-dimethyl-2-oxo-4-imidazolidinylidene)-

There total 3 articles about Acetamide, N-(3-(4-fluoro-3-trifluoromethylphenyl)-5,5-dimethyl-2-oxo-4-imidazolidinylidene)- 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: 71.0%

acetic anhydride (108-24-7) + 5-Imino-4,4-dimethyl-1-(α,α,α,4-tetrafluor-m-tolyl)-2-imidazolidinon (70842-08-9) → N-<5,5-Dimethyl-2-oxo-3-(α,α,α,4-tetrafluor-m-tolyl)-4-imidazolidinyliden>acetamid (92668-63-8)

Guidance literature:

In tetrahydrofuran; for 4h; Heating;

Reference yield:

α,α,α,4-Tetrafluor-m-tolylcarbamidsaeurephenylester (77140-72-8) → N-<5,5-Dimethyl-2-oxo-3-(α,α,α,4-tetrafluor-m-tolyl)-4-imidazolidinyliden>acetamid (92668-63-8)

Guidance literature:

Multi-step reaction with 2 steps

1: 1.) NaHCO₃, 2.) HCl / 1.) THF, 40 h, r.t., 2.) water

2: 71 percent / tetrahydrofuran / 4 h / Heating

With hydrogenchloride; sodium hydrogencarbonate; In tetrahydrofuran;

Reference yield:

4-Fluoro-3-trifluoromethylaniline (2357-47-3) → N-<5,5-Dimethyl-2-oxo-3-(α,α,α,4-tetrafluor-m-tolyl)-4-imidazolidinyliden>acetamid (92668-63-8)

Guidance literature:

Multi-step reaction with 3 steps

1: NaHCO₃ / tetrahydrofuran / 0.5 h / 22 - 23 °C

2: 1.) NaHCO₃, 2.) HCl / 1.) THF, 40 h, r.t., 2.) water

3: 71 percent / tetrahydrofuran / 4 h / Heating

With hydrogenchloride; sodium hydrogencarbonate; In tetrahydrofuran;

upstream raw materials:

acetic anhydride

5-Imino-4,4-dimethyl-1-(α,α,α,4-tetrafluor-m-tolyl)-2-imidazolidinon

α,α,α,4-Tetrafluor-m-tolylcarbamidsaeurephenylester

4-Fluoro-3-trifluoromethylaniline