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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 570845Generated: October 29, 2026

Water → HCID 25052193, compound

https://huagongshe.com/reaction/570845

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantBenzyl BromideHCID 7498—
ReactantCesium carbonateHCID 10796—
ReactantHCID 68504709HCID 68504709—
SolventDimethylformamideHCID 6228—
ProductHCID 25052193HCID 2505219322.8%

Reaction Conditions

Temperature80 °C

Reaction Steps

To a solution of 4-(3-cyano-4-methoxypyrrole-1-yl)benzoic acid ethyl ester (0.081 g) in dichloromethane (3 mL) was added boron tribromide (0.33 mL, 1 mol/L dichloromethane solution) under ice-cooling, and this mixture was stirred at same temperature for 2 hours. To this reaction mixture was added water, and this mixture was extracted with diethyl ether. This organic layer was washed with brine, dried over anhydrous magnesium sulfate. The solvent was removed under reduced pressure. The residue was purified by column chromatography on silica gel (eluent: ethyl acetate/n-hexane=1/1) to give 4-(3-cyano-4-hydroxypyrrole-1-yl)benzoic acid ethyl ester (0.052 g). To a solution of 4-(3-cyano-4-hydroxypyrrole-1-yl)benzoic acid ethyl ester (0.052 g) in N,N-dimethylformamide (4 mL) were added benzylbromide (0.038 g) and cesium carbonate (0.13 g) at room temperature, and this mixture was stirred at 80° C. for 5 hours. To this reaction mixture was added water at room temperature, and the precipitated solid was collected by filtration, and washed with methanol (5 mL) to give the title compound (0.016 g).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09023882B2
Source datasetuspto-grants-2015_05
ORD IDord-c80f832f665d49e5af5a8a04f954271c
Source noteuspto-grants-2015_05