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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1296411Generated: October 26, 2026

Sodium hydride → (R)-1-(5-acetoxyhexyl)-7-benzyl-3-methylxanthine

https://huagongshe.com/reaction/1296411

Reaction equation

Participants

RoleNameHCIDCharge
ReactantSodium hydrideHCID 24758—
Reactant7-Benzyl-3-methylxanthineHCID 685630—
Reactant(R)-5-Acetoxy-1-bromohexaneHCID 12619445—
SolventDimethyl SulfoxideHCID 679—
Product(R)-5-Acetoxy-1-bromohexaneHCID 12619445—
Product(R)-1-(5-acetoxyhexyl)-7-benzyl-3-methylxanthineHCID 53701360144%

Reaction Steps

To a stirring suspension of 7-benzyl-3-methylxanthine (11.1 g, 43.2 mmol) in dimethyl sulfoxide (100 ml) was added 95% sodium hydride (1.24 g, 52 mmol) in one portion. After stirring for 30 minutes, (R)-5-acetoxy-1-bromohexane (8.1 g, 45.3 mmol) was added neat. The (R)-5-Acetoxy-1-bromohexane was prepared according to methods described in U.S. Pat. No. 6,075,029 issued to Klein, J. P., Kumar, A. M., and Woodson, P on Jun. 13, 2000, which is incorporated herein by reference. After stirring at 80° C. for 16 hours and cooled to room temperature, the reaction was quenched by addition of water (350 ml) and extracted with ethyl acetate (5×50 ml). The combined extracts were washed with saturated aqueous sodium bicarbonate solution (50 ml), with saturated aqueous sodium chloride solution (50 ml) and dried over magnesium sulfate. Evaporation of the solvent under reduced pressure gave a residue which was purified by flash chromatography on silica gel eluting with ethyl acetate to give (R)-1-(5-acetoxyhexyl)-7-benzyl-3-methylxanthine (13.0 g, 76% yield).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07247630B2
Source datasetuspto-grants-2007_07
ORD IDord-71bb64e0253b4cb8ae0320fbe0d86bef
Source noteuspto-grants-2007_07