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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 361552Generated: October 26, 2026

Water → 1-(16-Heptadecenyl)-3,7-dimethylxanthine

https://huagongshe.com/reaction/361552

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
Reactant16-Heptadecenyl chlorideHCID 23295905—
ReactantTheobromine sodiumHCID 66980828—
Solventdimethylsulfoxide THFHCID 21830753—
Product1-(16-Heptadecenyl)-3,7-dimethylxanthineHCID 2329593685%

Reaction Conditions

Temperature60 °C

Reaction Steps

To a suspension of sodium theobromine (2.02 g, 10.0 mmol) in dimethylsulfoxide/tetrahydrofuran (2:1, 30 mL) was added 16-heptadecenyl chloride and the reaction stirred for 16 hours at 60° C. The mixture was poured into water (75 mL) and extracted with ethyl acetate (3×75 mL). The organic portions were combined, dried using magnesium sulfate, and the solvent evaporated to give a cream solid. Recrystallization from hot hexane yields 2.31 g (85% yield) 1-(16-Heptadecenyl)-3,7-dimethylxanthine as a white solid.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS05866576
Source datasetuspto-grants-1999_02
ORD IDord-3bbe6c5dde54493cb60844fa6ca0820e
Source noteuspto-grants-1999_02