5,5-diMethyl-2-(2,2,2-trifluoroacetyl)cyclohexane-1,3-dione

Base Information

• Chemical Name: 5,5-diMethyl-2-(2,2,2-trifluoroacetyl)cyclohexane-1,3-dione
• CAS No.: 893842-26-7
• Molecular Formula: C10H11F3O3
• Molecular Weight: 236.191
• Hs Code.: 2914700090
• Mol file: 893842-26-7.mol

Synonyms:2-trifluoroacetyldimedone;2-trifluoroacetyl-5,5-dimethylcyclohexane-1,3-dione;5,5-dimethyl-2-(trifluoroacetyl)cyclohexane-1,3-dione;

Chemical Property of 5,5-diMethyl-2-(2,2,2-trifluoroacetyl)cyclohexane-1,3-dione

Chemical Property:

• PSA: 51.21000
• LogP: 1.69220

Purity/Quality:

97% ^*data from raw suppliers

5,5-Dimethyl-2-(2,2,2-trifluoroacetyl)-cyclohexane-1,3-dione 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 5,5-diMethyl-2-(2,2,2-trifluoroacetyl)cyclohexane-1,3-dione

There total 2 articles about 5,5-diMethyl-2-(2,2,2-trifluoroacetyl)cyclohexane-1,3-dione 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: 88.0%

dimedone (126-81-8) + N-trifluoroacetylimidazole (1546-79-8) → 5,5-dimethyl-2-(2,2,2-trifluoroacetyl)cyclohexane-1,3-dione (893842-26-7)

Guidance literature:

With 1H-imidazole; In chloroform; at 20 ℃; for 0.75h;

DOI:10.1016/j.jfluchem.2006.08.003

Reference yield: 77.0%

dimedone (126-81-8) + trifluoroacetic acid (76-05-1) → 5,5-dimethyl-2-(2,2,2-trifluoroacetyl)cyclohexane-1,3-dione (893842-26-7)

Guidance literature:

trifluoroacetic acid; With 1,1'-carbonyldiimidazole; In chloroform;

dimedone; With 1H-imidazole; In chloroform; at 20 ℃; for 0.75h;

DOI:10.1016/j.bmc.2014.07.012

Reference yield: 81.0%

5,5-dimethyl-2-(2,2,2-trifluoroacetyl)cyclohexane-1,3-dione (893842-26-7) → 2-(1-hydroxy-2,2,2-trifluoroethyl)-5,5-dimethylcyclohexane-1,3-dione (1129225-62-2)

Guidance literature:

With triethylsilane; lithium perchlorate; trifluoroacetic acid; at 20 ℃; for 5h;

DOI:10.1134/S1070363208050290

upstream raw materials:

dimedone

N-trifluoroacetylimidazole

trifluoroacetic acid

Downstream raw materials:

2-(1-hydroxy-2,2,2-trifluoroethyl)-5,5-dimethylcyclohexane-1,3-dione

C₁₆H₁₄F₄N₂O

6,6-dimethyl-3-trifluoromethyl-1-(4-fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one

C₁₆H₁₀F₈N₂O

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