Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2393071Generated: October 29, 2026

Hydrogen Bromide → 1-(8-Acetoxy-9-bromononyl)-3,7-dimethylxanthine

https://huagongshe.com/reaction/2393071

Reaction equation

Participants

RoleNameHCIDCharge
ReactantHydrogen BromideHCID 260—
ReactantDichloromethaneHCID 6344—
ReactantSodium BicarbonateHCID 516892—
Reactant1-(8,9-Dihydroxynonyl)-3,7-dimethylxanthineHCID 9840808—
SolventAcetic AcidHCID 176—
Product1-(8-Acetoxy-9-bromononyl)-3,7-dimethylxanthineHCID 1533859796%

Reaction Steps

This example illustrates another method for synthesizing compound no. 1551 (in addition to the method described in Example 1). 1-(8,9-dihydroxynonyl)-3,7-dimethylxanthine (compound no. 1561, 428 mg, 1.3 mmol) was stirred with HBr (777 μl, 1.05 g of a 30% solution in acetic acid, 3.9 mmol) for 90 minutes. The mixture was then added to a flask containing aqueous sodium bicarbonate solution (10 ml, 1.35 g) and dichloromethane (10 ml) and stirred vigorously for 10 minutes. The layers were separated and the aqueous portion was washed with dichloromethane (3×15 ml). The organic portions were combined, dried with sodium sulfate and evaporated to give 1-(8-acetoxy-9-bromononyl)-3,7-dimethylxanthine as a yellow oil (550 mg, 96% yield). Without further purification, the oil was taken up in methanol (5 ml) and treated with a solution of sodium methoxide (prepared from 33 mg, 1.4 mmol sodium and 1.4 ml methanol). After 30 minutes, the reaction mixture was added to water (30 ml) and extracted with dichloromethane (3×40 ml). The organic portions were combined and dried to give an off-white solid. Recrystalization of the remaining solid was recrystalized in dichloromethane/petroleum ether, resulting in 380 mg of 1-(8,9-oxidononyl)-3,7-dimethylxanthine (91% yield).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS05804584
Source datasetuspto-grants-1998_09
ORD IDord-1692dc07dc414c5f9344bb2004171e88
Source noteuspto-grants-1998_09