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Basic Information
| CAS No.: | 21249-93-4 |
|---|---|
| Name: | (2,2,2-Trifluoroethyl)benzene |
| Molecular Structure: | |
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|
|
| Formula: | C8H7F3 |
| Molecular Weight: | 160.139 |
| Synonyms: | 2,2,2-trifluoroethylbenzene; |
| Density: | 1.155g/cm3 |
| Melting Point: | 137 °C |
| Boiling Point: | 122.8°C at 760 mmHg |
| Flash Point: | 21.4°C |
| PSA: | 0.00000 |
| LogP: | 2.79140 |
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Synthetic route
- 100-39-0
benzyl bromide
- 81290-20-2
(trifluoromethyl)trimethylsilane
- 21249-93-4
(2,2,2-trifluoroethyl)benzene
Conditions
| Conditions | Yield |
|---|---|
| With potassium fluoride; copper(l) iodide; N-(EtOCH2CH2OCH2)-N-methylmorpholinium bis(CF3SO2)amide at 80℃; for 8h; | 90% |
| With C13H27CuN2O(1+) In N,N-dimethyl-formamide at 25℃; for 112h; | 58 %Spectr. |
- 353-83-3
1,1,1-trifluoro-2-iodoethane
- 98-80-6
phenylboronic acid
- 21249-93-4
(2,2,2-trifluoroethyl)benzene
Conditions
| Conditions | Yield |
|---|---|
| With [2,2]bipyridinyl; nickel(II) bromide dimethoxyethane; potassium phosphate In dimethyl sulfoxide at 80℃; for 12h; Reagent/catalyst; Solvent; Concentration; Inert atmosphere; Sealed tube; | 85% |
Conditions
| Conditions | Yield |
|---|---|
| With potassium fluoride; copper(l) iodide In N,N-dimethyl-formamide at 110 - 120℃; for 8h; | 84% |
| With potassium fluoride; copper(l) iodide In various solvent(s) at 80℃; for 8h; | 68% |
| With potassium fluoride; copper(l) iodide In N,N-dimethyl-formamide at 100 - 120℃; for 7h; |
- 680-15-9
2,2-difluoro-2-(fluorosulfonyl)acetate
- 620-05-3
iodomethylbenzene
- 21249-93-4
(2,2,2-trifluoroethyl)benzene
Conditions
| Conditions | Yield |
|---|---|
| With copper(l) iodide In N,N-dimethyl-formamide at 70℃; for 2h; | 81% |
| With copper In N,N-dimethyl-formamide at 80℃; for 3h; | 80% |
- 405-42-5
2',2'-difluorostyrene
- 21249-93-4
(2,2,2-trifluoroethyl)benzene
Conditions
| Conditions | Yield |
|---|---|
| With potassium fluoride; 18-crown-6 ether In N,N-dimethyl-formamide at 150℃; for 8h; hydrofluorination; | 75% |
- 100-39-0
benzyl bromide
- 21249-93-4
(2,2,2-trifluoroethyl)benzene
Conditions
| Conditions | Yield |
|---|---|
| With copper(l) iodide In N,N,N,N,N,N-hexamethylphosphoric triamide; N,N-dimethyl-formamide at 40℃; for 3h; | 74% |
Conditions
| Conditions | Yield |
|---|---|
| With 4,4'-di-tert-butyl-2,2'-bipyridine; magnesium chloride; nickel dibromide; zinc In N,N-dimethyl acetamide at 80℃; for 12h; Inert atmosphere; Schlenk technique; | 74% |
| With 4,4'-di-tert-butyl-2,2'-bipyridine; magnesium chloride; nickel dibromide; zinc In N,N-dimethyl acetamide at 80℃; for 12h; Inert atmosphere; Schlenk technique; | 74% |
Conditions
| Conditions | Yield |
|---|---|
| With 4,4'-di-tert-butyl-2,2'-bipyridine; magnesium chloride; nickel dibromide; zinc In N,N-dimethyl acetamide at 80℃; for 12h; Reagent/catalyst; Solvent; Temperature; Schlenk technique; Inert atmosphere; | 73% |
| With 4,4'-di-tert-butyl-2,2'-bipyridine; magnesium chloride; nickel dibromide; zinc In N,N-dimethyl acetamide at 80℃; for 12h; Catalytic behavior; Reagent/catalyst; Solvent; Inert atmosphere; Schlenk technique; | 73 %Spectr. |
- 680-15-9
2,2-difluoro-2-(fluorosulfonyl)acetate
- 100-39-0
benzyl bromide
- 21249-93-4
(2,2,2-trifluoroethyl)benzene
Conditions
| Conditions | Yield |
|---|---|
| With copper(l) iodide In N,N-dimethyl-formamide at 80℃; for 3.5h; | 72.4% |
| With copper In N,N-dimethyl-formamide at 80℃; for 3h; | 70% |
| With copper(l) iodide In various solvent(s) at 55℃; for 8h; | 70% |
- 756-21-8
ethyl 2,2-difluoro-2-(fluorosulfonyl)acetate
- 100-51-6
benzyl alcohol
- 21249-93-4
(2,2,2-trifluoroethyl)benzene
Conditions
| Conditions | Yield |
|---|---|
| With potassium fluoride; copper(l) iodide In N,N-dimethyl-formamide at 70℃; for 9h; | 72% |
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(2,2,2-Trifluoroethyl)benzene
