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
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Water | HCID 962 | — |
| Reactant | 16-Heptadecenyl chloride | HCID 23295905 | — |
| Reactant | Theobromine sodium | HCID 66980828 | — |
| Solvent | dimethylsulfoxide THF | HCID 21830753 | — |
| Product | 1-(16-Heptadecenyl)-3,7-dimethylxanthine | HCID 23295936 | 85% |
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
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US05866576 |
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| Source dataset | uspto-grants-1999_02 |
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| ORD ID | ord-3bbe6c5dde54493cb60844fa6ca0820e |
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| Source note | uspto-grants-1999_02 |
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