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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2393325Generated: October 31, 2026

Dimethyl Sulfoxide → 1-(6-Oxohexyl)-3,7-dimethylxanthine

https://huagongshe.com/reaction/2393325

Reaction equation

Participants

RoleNameHCIDCharge
ReactantDimethyl SulfoxideHCID 679—
ReactantTriethylamineHCID 8471—
ReactantOxalyl chlorideHCID 65578—
Reactant1-(6-Hydroxyhexyl)-3,7-dimethylxanthineHCID 9925690—
SolventWaterHCID 962—
SolventDichloromethaneHCID 6344—
Product1-(6-Oxohexyl)-3,7-dimethylxanthineHCID 1869106587.2%

Reaction Steps

Dimethyl sulfoxide (156 μl, 172 mg, 2.2 mmol) was slowly added to a solution of oxalyl chloride (103 μl, 150 mg, 1.2 mmol) in dichloromethane at -78° C. A solution of 1-(6-hydroxyhexyl)-3,7-dimethylxanthine (300 mg, 1.1 mmol), prepared in the previous step, in dichloromethane (5 ml) was added to this solution and the resulting reaction mixture stirred for 15 minutes. The cold bath was removed after addition of triethylamine (765 μl, 555 mg, 5.5 mmol). The reaction was added at ambient temperature to 20 ml water and extracted with three 50 ml aliquots of methylene chloride. The combined organic layers were washed with 1% aqueous hydrogen chloride (20 ml), saturated aqueous sodium bicarbonate (20 ml), and saturated aqueous salt solution (20 ml), and then dried over sodium sulfate. Evaporating the solvents and recrystallizing a residue in chloroform/petroleum ether produced 267 mg of 1-(6-oxohexyl)-3,7-dimethylxanthine (87% yield).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS05807861
Source datasetuspto-grants-1998_09
ORD IDord-431e32a8a1204c22a29462e560cf13be
Source noteuspto-grants-1998_09