ChemicalBook--->CAS DataBase List--->1049730-91-7

1049730-91-7

1049730-91-7 Structure

1049730-91-7 Structure
IdentificationBack Directory
[Name]

3-bromo-4-trifluoromethoxyanisole
[CAS]

1049730-91-7
[Synonyms]

3-bromo-4-trifluoromethoxyanisole
2-BroMo-4-Methoxy-1-(trifluoroMethoxy)benzene
[Molecular Formula]

C8H6BrF3O2
[MDL Number]

MFCD20485915
[MOL File]

1049730-91-7.mol
[Molecular Weight]

271.03
Chemical PropertiesBack Directory
[Boiling point ]

212.8±35.0 °C(Predicted)
[density ]

1.594±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[Appearance]

Colorless to light yellow Liquid
Spectrum DetailBack Directory
[Spectrum Detail]

3-bromo-4-trifluoromethoxyanisole(1049730-91-7)1HNMR
Hazard InformationBack Directory
[Synthesis]

3-Bromo-4-trifluoromethoxyphenol

886496-88-4

Iodomethane

74-88-4

3-bromo-4-trifluoromethoxyanisole

1049730-91-7

Intermediate 5: Synthesis of 2-bromo-4-methoxy-1-(trifluoromethoxy)benzene; A mixture of 3-bromo-4-(trifluoromethoxy)phenol (2.0 g, 7.8 mmol), potassium carbonate (K2CO3, 1.62 g, 11.72 mmol) and iodomethane (MeI, 2.43 mL, 39.06 mmol) in acetone (13 mL) was at room temperature stirred for 10 hours. After completion of the reaction, the acetone was evaporated under reduced pressure and the crude product was diluted with dichloromethane (CH2Cl2), washed sequentially with saturated saline, dried over anhydrous sodium sulfate (Na2SO4) and concentrated under reduced pressure. The residue was purified by column chromatography on silica gel (SiO2) using a gradient elution with hexane solution of 0 to 50% ethyl acetate (EtOAc) to afford the target product Intermediate 5 (2.10 g, 99% yield).

[References]

[1] Patent: WO2009/65035, 2009, A1. Location in patent: Page/Page column 67
[2] Patent: WO2008/135826, 2008, A2. Location in patent: Page/Page column 173
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