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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 506981Generated: November 4, 2026

Potassium Carbonate → methyl 4-methyl-3-[1-oxo-7-{[(trifluoromethyl)sulfonyl]oxy} isoquinolin-2(1H)-yl]benzoate

https://huagongshe.com/reaction/506981

Reaction equation

Participants

RoleNameHCIDCharge
ReactantPotassium CarbonateHCID 11430—
Reactant1,1,1-Trifluoro-N-phenylmethanesulfonamideHCID 68012—
Reactantmethyl 3-(7-hydroxy-1-oxoisoquinolin-2(1H)-yl)-4-methylbenzoateHCID 67018571—
SolventTetrahydrofuranHCID 8028—
Productmethyl 4-methyl-3-[1-oxo-7-{[(trifluoromethyl)sulfonyl]oxy} isoquinolin-2(1H)-yl]benzoateHCID 8662085481.2%

Reaction Conditions

Temperature120 °C

Reaction Steps

Methyl 3-(7-hydroxy-1-oxoisoquinolin-2(1H)-yl)-4-methylbenzoate (529 mg), N-phenyltrifluoromethanesulfonamide (612 mg) and potassium carbonate (709 mg) were stirred in THF (15 ml) and heated under microwave irradiation (Personal Chemistry Emrys Optimizer with 300 W magnetron) at 120° C. for 10 minutes. The reaction mixture was concentrated and the residue was dissolved in ethyl acetate and washed with water (×2), brine, dried (magnesium sulfate) and concentrated. Purification by column chromatography with a gradient of iso-hexane to 30% ethyl acetate/iso-hexane yielded methyl 4-methyl-3-[1-oxo-7-{[(trifluoromethyl)sulfonyl]oxy} isoquinolin-2(1H)-yl]benzoate as a white solid (613 mg); NMR Spectrum: (DMSOd6) 2.15 (s, 3H), 3.86 (s, 3H), 6.89 (d, 1H), 7.50 (d, 1H), 7.60 (d, 1H), 7.90 (s, 1H), 7.93 (d, 1H), 8.00 (m, 2H), 8.20 (s, 1H); Mass Spectrum: M+Na+ 464.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07786115B2
Source datasetuspto-grants-2010_08
ORD IDord-a26e388aa6184b8387553dba41f26b9d
Source noteuspto-grants-2010_08