HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1676333Generated: October 31, 2026
Dimethylformamide → 5-bromo-2-chloro-3-methylpyrimidin-4(3H)-one
https://huagongshe.com/reaction/1676333
Participants
| Role | Name | HCID | Charge |
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| Reactant | Dimethylformamide | HCID 6228 | — |
| Reactant | Methyl iodide | HCID 6328 | — |
| Reactant | Lithium hydride | HCID 62714 | — |
| Reactant | 5-Bromo-2-chloropyrimidin-4-ol | HCID 11160114 | — |
| Solvent | 1,2-Dimethoxyethane | HCID 8071 | — |
| Product | 5-bromo-2-chloro-3-methylpyrimidin-4(3H)-one | HCID 67348611 | 72% |
Reaction Steps
To a solution of 5-bromo-2-chloropyrimidin-4(3H)-one (1.00 g, 4.78 mmol) in DME (12 mL)/DMF (3 mL) under nitrogen at 0° C., LiH (0.044 g, 5.25 mmol) was added, and the reaction mixture was stirred for 15 minutes at room temperature. Iodomethane (0.589 mL, 9.45 mmol) was then added and the reaction mixture was stirred at room temperature for 30 minutes and then at 60° C. for 1.5 hours. The reaction mixture was quenched with H2O and then partitioned between EtOAc and saturated aqueous NaCl. The phases were separated, and the aqueous phase was re-extracted with EtOAc (1×). The combined organic layers were dried (Na2SO4), filtered and concentrated to yield a crude yellow oil. The crude product was purified by flash column chromatography, eluting with 25:1 dichloromethane/EtOAc. The desired product (0.764 g, 72%) was obtained as a yellow crystalline solid. 1H NMR (400 MHz, DMSO-d6) δ 8.26 (s, 1H), 3.59 (s, 3H). LRMS (ESI pos) m/e 223, 225 (M+, Br pattern).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08003662B2 |
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| Source dataset | uspto-grants-2011_08 |
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| ORD ID | ord-acf395d4e2ad4d388ac43f997db13eda |
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| Source note | uspto-grants-2011_08 |
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