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ChemicalBook--->CAS DataBase List--->458-92-4

458-92-4

458-92-4 Structure

458-92-4 Structure
IdentificationMore
[Name]

(DIFLUOROMETHOXY)BENZENE
[CAS]

458-92-4
[Synonyms]

ALPHA,ALPHA-DIFLUOROANISOLE
(DIFLUOROMETHOXY)BENZENE
α,α-Difluoroanisole
1,1-difluoroanisole
alpha,alpha-Difluoroanisole,98+%
A,A-DIFLUOROANISOLE
alpha-Difluoroanisole
(Difluoromethyl)phenyl ether
Difluoromethyl(phenyl) ether
Difluoromethylphenyl ether
Phenyl(difluoromethyl) ether
[EINECS(EC#)]

207-283-1
[Molecular Formula]

C7H6F2O
[MDL Number]

MFCD00068184
[Molecular Weight]

144.12
[MOL File]

458-92-4.mol
Chemical PropertiesBack Directory
[Boiling point ]

98 °C
[density ]

1.2
[refractive index ]

1.45
[Fp ]

43.1±19.0℃
[storage temp. ]

Sealed in dry,Room Temperature
[Specific Gravity]

1.200
[Appearance]

Colorless to light yellow Liquid
[λmax]

270nm(EtOH)(lit.)
[CAS DataBase Reference]

458-92-4(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

F
[Risk Statements ]

R10:Flammable.
[Safety Statements ]

S16:Keep away from sources of ignition-No smoking .
[RIDADR ]

1993
[Hazard Note ]

Flammable
[HazardClass ]

FLAMMABLE
[PackingGroup ]

III
[HS Code ]

29093090
Hazard InformationBack Directory
[Chemical Properties]

Clear colorless liquid
[Synthesis]

Trifluoromethane

75-46-7

Phenol

108-95-2

(DIFLUOROMETHOXY)BENZENE

458-92-4

At room temperature, 0.28 g (0.003 mol) of phenol, 1.7 g (0.03 mol) of potassium hydroxide (KOH), an appropriate amount of water, and dioxane were added as solvents to a 50 mL round bottom flask. The reaction mixture was heated to 50°C, followed by the passage of trifluoromethane gas bubbling through the reaction solution for 2 hours. After completion of the reaction, the mixture was stirred at 50 °C overnight. The yield of difluoromethoxybenzene was calculated to be 70% by 19F NMR analysis (Figures 1 and 2 show the 19F NMR decoupling and proton coupling spectra of the reaction mixture and the purified difluoromethoxybenzene, respectively), using the 19F NMR integral signal of the HF2CO group as an internal standard.

[References]

[1] Patent: WO2014/113412, 2014, A1. Location in patent: Page/Page column 4
[2] Journal of Organic Chemistry, 2013, vol. 78, # 17, p. 8904 - 8908
Spectrum DetailBack Directory
[Spectrum Detail]

(DIFLUOROMETHOXY)BENZENE(458-92-4)1HNMR
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