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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2188865Generated: October 31, 2026

Formaldehyde → 2-(4H-benzo[d][1,3]dioxin-6-yl)acetonitrile

https://huagongshe.com/reaction/2188865

Reaction equation

Participants

RoleNameHCIDCharge
ReactantFormaldehydeHCID 712—
Reactant4-Hydroxybenzyl cyanideHCID 26548—
Reactantp-Toluenesulfonic acid monohydrateHCID 521998—
SolventTolueneHCID 1140—
Product2-(4H-benzo[d][1,3]dioxin-6-yl)acetonitrileHCID 591662219,757.2%

Reaction Steps

To a solution of (4-hydroxyphenyl)acetonitrile (17.3 g, 0.13 mol) in toluene (350 mL) were added paraformaldehyde (39.0 g, 0.43 mmol) and toluene-4-sulfonic acid monohydrate (2.5 g, 13 mmol) at room temperature. The reaction mixture was heated at reflux for 1 hour. Toluene was removed by evaporation. Water (150 mL) and ethyl acetate (150 mL) were added. The organic layer was separated and the aqueous layer was extracted with ethyl acetate. The combined organics were washed with brine, dried over Na2SO4 and evaporated under vacuum. The residue was separated by preparative HPLC to give 2-(4H-benzo[d][1,3]dioxin-6-yl)acetonitrile (7.35 g, 32%). 1H NMR (400 MHz, CDCl3) δ 7.07-7.11 (m, 1H), 6.95-6.95 (m, 1H), 6.88 (d, J=11.6 Hz, 1H), 5.24 (s, 2H), 4.89 (s, 2H), 3.67 (s, 2H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08324207B2
Source datasetuspto-grants-2012_12
ORD IDord-78e1b8c281c84f6abae3feedb41759c9
Source noteuspto-grants-2012_12