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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 707550Generated: October 30, 2026

Water → 4-Formyl-3-[(1-methylethyl)sulfonyl]benzonitrile

https://huagongshe.com/reaction/707550

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantBenzenesulfonic acid, 4-methyl-, compd. with pyridine (1:1)HCID 466102—
Reactant4-(1,3-Dioxan-2-yl)-3-(propan-2-ylsulfonyl)benzonitrileHCID 58133807—
SolventPropan-2-one--water (1/1)HCID 18366337—
Product4-Formyl-3-[(1-methylethyl)sulfonyl]benzonitrileHCID 58133848—

Reaction Conditions

Temperature165 °C

Reaction Steps

In an Emrys microwave, 4-(1,3-dioxan-2-yl)-3-(propan-2-ylsulfonyl)benzonitrile (1090 mg, 3.7 mmol) and pyridinium 4-toluenesulfonate (696 mg, 2.8 mmol; 0.75 eq.) in acetone/water (1:1, 15 ml) were heated with stirring at 165° C. for 7 min. The reaction mixture was then added to water (150 ml) and extracted with dichloromethane (9×30 ml). The combined organic phases were subsequently washed with saturated sodium chloride solution (30 ml), dried over sodium sulfate, filtered and concentrated under reduced pressure. The crude product was subjected to flash chromatography on silica gel (mobile phase: cyclohexane→cyclohexane/ethyl acetate 3:2). The title compound was isolated as a solid (0.764 g, 87% of theory).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09174997B2
Source datasetuspto-grants-2015_11
ORD IDord-84088fdeabb345ed87533a4deef4fea8
Source noteuspto-grants-2015_11