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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1838501Generated: October 30, 2026

Water → 3,5-Difluoro-4-(methylthio)benzaldehyde

https://huagongshe.com/reaction/1838501

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
Reactant3,4,5-TrifluorobenzaldehydeHCID 2776954—
ReactantSodium methanethiolateHCID 4378561—
SolventTetrahydrofuranHCID 8028—
Product3,5-Difluoro-4-(methylthio)benzaldehydeHCID 2274668262.5%

Reaction Steps

To a solution of 3,4,5-trifluorobenzaldehyde (30.0 g, 0.187 mol) in anhydrous THF (400 mL) cooled in a cold water bath was added sodium thiomethoxide (14.4 g, 0.20 mol) in portions over 30 minutes. The mixture was stirred at room temperature for 18 hours, then poured into water and extracted with dichloromethane (1×500 mL, 2×200 mL). The combined extracts were washed with water, dried using magnesium sulfate, and concentrated. Purification of the product by silica gel chromatography using 2% dichloromethane/5% ethyl acetate in hexanes gave the 3,5-difluoro-4-(methylthio)-benzaldehyde as a clear colorless liquid (22.0 g, 62%). 1H NMR (CDCl3/400 MHz) 9.86 (t, J=1.5, 1H), 7.34-7.39 (m, 2H), 2.55 (s, 3H). HRMS m/z 188.0099 (M+, calcd 188.0107).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS06673818B2
Source datasetuspto-grants-2004_01
ORD IDord-af90c1147bbd4678abeee3270d8cbe4c
Source noteuspto-grants-2004_01