2,2,2-trifluoro-1-p-tolylethanone

2,2,2-trifluoro-1-p-tolylethanone - Names and Identifiers

Name	4-(trifluoroacetyl)toluene
Synonyms	4-(TRIFLUOROACETYL)TOLUENE 4-(trifluoroacetyl)toluene 4-(Trifluoroacetyl)toluene 4-(Trifluoroacetyl)toluene97. (Trifluoromethyl)-p-tolylketone 2,2,2-trifluoro-1-p-tolylethanone 2,2,2-TRIFLUORO-1-(P-TOLYL)ETHANONE 2,2,2-TRIFLUORO-4'-METHYLACETOPHENONE 4'-METHYL-2,2,2-TRIFLUOROACETOPHENONE 2,2,2-trifluoro-1-(4-methylphenyl)ethanone Ethanone,2,2,2-trifluoro-1-(4-methylphenyl)-
CAS	394-59-2
InChI	InChI=1/C9H7F3O/c1-6-2-4-7(5-3-6)8(13)9(10,11)12/h2-5H,1H3

2,2,2-trifluoro-1-p-tolylethanone - Physico-chemical Properties

Molecular Formula	C9H7F3O
Molar Mass	188.15
Density	1.2304 g/cm3(Temp: 25 °C)
Melting Point	5°C
Boling Point	70 °C
Flash Point	70-72°C/15mm
Vapor Presure	0.439mmHg at 25°C
Appearance	clear liquid
Color	Colorless to Light yellow to Light orange
BRN	1870406
Storage Condition	Sealed in dry,Room Temperature
Refractive Index	1.47
MDL	MFCD00052338

2,2,2-trifluoro-1-p-tolylethanone - Risk and Safety

Hazard Symbols	Xi - Irritant
Risk Codes	36/37/38 - Irritating to eyes, respiratory system and skin.
Safety Description	S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36/37/39 - Wear suitable protective clothing, gloves and eye/face protection. S37 - Wear suitable gloves.
HS Code	29039990
Hazard Class	IRRITANT

2,2,2-trifluoro-1-p-tolylethanone - Reference Information

Use

4-(trifluoroacetyl) toluene is a trifluoromethyl derivative. Trifluoromethyl compounds show many very unique physical and chemical properties due to their strong electron-withdrawing and highly esterophilic properties. It is also an important pharmaceutical intermediate.

preparation

in a nitrogen atmosphere, put a polytetrafluoroethylene magnet in a reactor, add 0.4 mmol p-methylbenzene diazo tetrafluoroborate, 0.1 mmol cuprous oxide, 1
mL dichloromethane, 0.8 mmol dimethyl sulfoxide, finally add 1.2 mmol ethyl trifluoropruvate, stir and react at 25°C in a closed system for 16
h, the organic phase was extracted 3 times with ether, 10 mL each time, combined with organic phase, washed 3 times with distilled water, the organic phase was dried with anhydrous magnesium sulfate, filtered, and then spin-evaporated to remove the organic
agent; The obtained crude product was eluted by silica gel column chromatography with n-pentane as eluent to obtain 4-(trifluoroacetyl) toluene (separation yield 86%).

Last Update：2024-04-09 15:16:50