HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 883003Generated: October 28, 2026
Water → Ethyl 4-(2-fluorophenyl)-2-(methylthio)-5-pyrimidinecarboxylate
https://huagongshe.com/reaction/883003
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Water | HCID 962 | — |
| Reactant | Sodium Acetate | HCID 517045 | — |
| Reactant | HCID 54124074 | HCID 54124074 | — |
| Reactant | HCID 178513471 | HCID 178513471 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Product | Ethyl 4-(2-fluorophenyl)-2-(methylthio)-5-pyrimidinecarboxylate | HCID 59421256 | — |
Reaction Steps
3-Dimethylamino-2-(2-fluoro-benzoyl)-acrylic acid ethyl ester was dissolved in DMF (100 mL). To the solution was added isothiourea sulfate (18.92 g, 68.0 mmol) and NaOAc (23.24 g, 0.28 mol). The reaction mixture was heated at 80-90° C. overnight. Water was added to the cooled solution. The product was extracted with EtOAc (3×100 mL). The combined organic layers were washed with a saturated aqueous NaHCO3 solution and water, dried over Na2SO4, and concentrated. The crude product was purified by column chromatography (1 L silica, EtOAc) to give 4-(2-fluoro-phenyl)-2-methylsulfanyl-pyrimidine-5-carboxylic acid ethyl ester as a yellow oil (11.86 g, 40.6 mmol, 60% over 2 steps).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08236815B2 |
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| Source dataset | uspto-grants-2012_08 |
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| ORD ID | ord-2bbe4968b9ae4561a3fb232734526467 |
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| Source note | uspto-grants-2012_08 |
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