ChemicalBook--->CAS DataBase List--->53145-38-3

53145-38-3

53145-38-3 Structure

53145-38-3 Structure
IdentificationBack Directory
[Name]

2-Chloro-6-fluoroanisole
[CAS]

53145-38-3
[Synonyms]

2-chloro-6-fluorobenzoether
1-Chloro-3-fluoro-2-Methoxybenzene
Benzene, 1-chloro-3-fluoro-2-methoxy-
2-Chloro-6-fluoroanisole ISO 9001:2015 REACH
1-Chloro-3-fluoro-2-methoxybenzene, 2-Chloro-6-fluorophenyl methyl ether
[Molecular Formula]

C7H6ClFO
[MDL Number]

MFCD01631573
[MOL File]

53145-38-3.mol
[Molecular Weight]

160.58
Chemical PropertiesBack Directory
[Boiling point ]

186.4±20.0 °C(Predicted)
[density ]

1.239±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Benzene (Slightly), Chloroform, Methanol (Slightly)
[form ]

Oil
[color ]

Clear Colourless
[InChI]

1S/C7H6ClFO/c1-10-7-5(8)3-2-4-6(7)9/h2-4H,1H3
[InChIKey]

QASFEHCRPLPGES-UHFFFAOYSA-N
[SMILES]

COc1c(F)cccc1Cl
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS07
[Signal word ]

Warning
[Hazard statements ]

H227-H315-H319-H335
[Precautionary statements ]

P210e-P261-P280a-P305+P351+P338-P405-P501a
[Hazard Codes ]

Xi
[WGK Germany ]

WGK 3
[HazardClass ]

IRRITANT
[PackingGroup ]

III
[HS Code ]

2909309090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Chemical Properties]

Colorless liquid
[Synthesis]

2-Chloro-6-fluorophenol

2040-90-6

Iodomethane

74-88-4

2-Chloro-6-fluoroanisole

53145-38-3

GENERAL STEPS: Iodomethane (850 μL, 13.646 mmol) and potassium carbonate (943 mg, 6.824 mmol) were sequentially added to a solution of tetrahydrofuran (10 mL) containing 2-chloro-6-fluorophenol (1.0 g, 6.824 mmol). The reaction mixture was stirred at room temperature for 3 hours. Upon completion of the reaction, the mixture was transferred to a partition funnel and extracted with ether (50 mL) and water (50 mL) by partition. The organic phase was separated and washed with water (2 x 20 mL). The organic layer was dried over anhydrous sodium sulfate and concentrated under reduced pressure to give 2-chloro-6-fluoroanisole as a colorless liquid in 94% yield (1.03 g).1H NMR (400 MHz, CD3OD) δ: 3.90-3.91 (s, 3H), 7.01-7.12 (m, 2H), 7.18-7.21 (m, 1H).

[References]

[1] Patent: WO2007/34325, 2007, A1. Location in patent: Page/Page column 47
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