ChemicalBook--->CAS DataBase List--->198205-95-7

198205-95-7

198205-95-7 Structure

198205-95-7 Structure
IdentificationMore
[Name]

2'-TRIFLUOROMETHYL-BIPHENYL-4-CARBALDEHYDE
[CAS]

198205-95-7
[Synonyms]

2'-(TRIFLUOROMETHYL)[1,1'-BIPHENYL]-4-CARBALDEHYDE
2'-TRIFLUOROMETHYL-BIPHENYL-4-CARBALDEHYDE
4-[2-(TRIFLUOROMETHYL)PHENYL]BENZALDEHYDE
AKOS BAR-1774
2'-Trifluoromethyl-biphenyl-4-carbaldehyde
[Molecular Formula]

C14H9F3O
[MDL Number]

MFCD01631916
[Molecular Weight]

250.22
[MOL File]

198205-95-7.mol
Chemical PropertiesBack Directory
[Boiling point ]

338.8±42.0 °C(Predicted)
[density ]

1.251±0.06 g/cm3(Predicted)
[CAS DataBase Reference]

198205-95-7(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36
Hazard InformationBack Directory
[Synthesis]

2-Bromobenzotrifluoride

392-83-6

4-Formylphenylboronic acid

87199-17-5

2'-TRIFLUOROMETHYL-BIPHENYL-4-CARBALDEHYDE

198205-95-7

A solution of tetrakis(triphenylphosphine)palladium (0.05 g) and sodium carbonate (0.7 g) in water (5 mL) was sequentially added to a stirred solution of o-bromobenzotrifluorotoluene (0.7 g, 2.75 mmol) and 4-formylbenzeneboronic acid (0.5 g, 3.3 mmol) in dioxane (20 mL) under nitrogen protection and at 80 °C. The reaction mixture was stirred at 100±5°C for 6 hours. Upon completion of the reaction, the solvent was removed by evaporation and the residue was diluted to 50 mL with ethyl acetate and washed with deionized water. The solvent was again removed by evaporation and the residue was purified by silica gel column chromatography (FCC) to afford 2'-(trifluoromethyl)-[1,1'-biphenyl]-4-carbaldehyde (0.61 g, 88% yield) as a milky white solid.1H-NMR (CDCl3) δ: 7.49 (d, 1H, J = 7.41 Hz); 7.48 (d, 2H, J = 8.13 Hz); 7.61-7.53 (m, 2H); 7.76 (d, 1H, J = 7.8 Hz); 7.91 (d, 2H, J = 8.34 Hz); 10.07 (s, 1H).

[References]

[1] Patent: WO2010/42998, 2010, A1. Location in patent: Page/Page column 95
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