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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1096995Generated: October 31, 2026

Acetonitrile → HCID 57930994, compound

https://huagongshe.com/reaction/1096995

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetonitrileHCID 6342—
ReactantPotassium Phosphate, TribasicHCID 62657—
Reactant1-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazoleHCID 2760077—
ReactantMethyl 4-bromo-3-ethoxybenzoateHCID 66782630—
SolventWaterHCID 962—
ProductHCID 57930994HCID 57930994—

Reaction Conditions

Temperature100 °C

Reaction Steps

1-Methyl-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole (183 mg, 0.88 mmol), potassium phosphate (374 mg, 1.76 mmol) and dichloro(1,1-bis(diphenylphosphino)-ferrocene)palladium(II) dichloromethane adduct (9.6 mg, 0.012 mmol) were added to an acetonitrile solution (3 mL) of methyl 4-bromo-3-ethoxybenzoate (152 mg, 0.59 mmol), and stirred overnight at 100° C. The reaction liquid was cooled to room temperature, and water was added to it. This was extracted with ethyl acetate, washed with saturated saline water, and dried with magnesium sulfate. The solution was filtered, and concentrated under reduced pressure, and the resulting residue was purified through silica gel column chromatography (hexane/ethyl acetate=50/50) to obtain the title compound as a white solid.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08138197B2
Source datasetuspto-grants-2012_03
ORD IDord-365589fdf9c54fb99f0feb703fbad90c
Source noteuspto-grants-2012_03