ChemicalBook--->CAS DataBase List--->25199-84-2

25199-84-2

25199-84-2 Structure

25199-84-2 Structure
IdentificationBack Directory
[Name]

2-HYDROXY-4-(TRIFLUOROMETHYL)QUINOLINE
[CAS]

25199-84-2
[Synonyms]

BUTTPARK 33\04-80
4-(Trifluoromethyl)quinolin-2-ol
4-Trifluoromethyl-1H-quinolin-2-one
4-trifluoroMethyl-2(1H)-quinolinone
4-(trifluoromethyl)quinolin-2(1H)-one
2-hydroxy-4-(trifluoroMethyl)quinqline
4--(TrifluoroMethyl)quinoline-2(H)-one
2-HYDROXY-4-(TRIFLUOROMETHYL)QUINOLINE
2-Hydroxy-4-(trifluoromethyl)quinoline ,98%
[Molecular Formula]

C10H6F3NO
[MDL Number]

MFCD03407380
[MOL File]

25199-84-2.mol
[Molecular Weight]

213.16
Chemical PropertiesBack Directory
[Melting point ]

>240°C
[Boiling point ]

284 ºC
[density ]

1.391
[Fp ]

126 ºC
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

Solid
[color ]

White
[InChI]

InChI=1S/C10H6F3NO/c11-10(12,13)7-5-9(15)14-8-4-2-1-3-6(7)8/h1-5H,(H,14,15)
[InChIKey]

UUROBWTVZZNDFD-UHFFFAOYSA-N
[SMILES]

N1C2=C(C=CC=C2)C(C(F)(F)F)=CC1=O
[CAS DataBase Reference]

25199-84-2
Hazard InformationBack Directory
[Chemical Properties]

White solid
[Synthesis]

4-Trifluoromethylquinolin-2(1H)-one was prepared by reacting aniline and ethyl-4,4,4-trifluoroacetoacetate stirred in toluene.
Experimental Procedure: In a 1 L round flask fitted with a reflux condenser a mixture of 25.60 g aniline, 50.0 g ethyl-4,4,4-trifluoroacetoacetate 300 ml toluene was heated to reflux in an oil bath at 130 °C. After 20 min 3 ml water was added and the mixture was heated at reflux for another 24 h. the reaction mixture was cooled to room temperature and concentrated under reduced pressure. A round flask with 200 mL H2SO4 was heated to 80°C and the crude oil from the step before was added in portions to the H2SO4 keeping the internal temperature below 90°C, total addition time was approximately 40 min. After addition was complete, the mixture was stirred at 80°C for 1 h, cooled and poured onto 400 g crushed ice. The resulting solids were filtered, washed with water, and dried under vacuum at 40°C to give 33.0 g (50%) product (4-Trifluoromethylquinolin-2(1H)-one) as a colorless solid. 
Safety DataBack Directory
[Safety Statements ]

24/25
[HS Code ]

29339900
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Sulfuric acid-->Ethyl 4,4,4-trifluoroacetoacetate-->4-Fluoroaniline-->4,4,4-trifluoro-3-oxo-N-phenylbutanamide-->Aniline
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