HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 426278Generated: October 31, 2026
Sodium hydride → 5-[Cyano-(5-isopropyl-2,6-dimethoxy-pyrimidin-4-yl)-methyl]-isophthalonitrile
https://huagongshe.com/reaction/426278
Participants
| Role | Name | HCID | Charge |
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| Reactant | Sodium hydride | HCID 24758 | — |
| Reactant | 5-Isopropyl-6-chloro-2,4-dimethoxypyrimidine | HCID 16088186 | — |
| Reactant | 5-Cyanomethyl-isophthalonitrile | HCID 66705567 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Product | 5-[Cyano-(5-isopropyl-2,6-dimethoxy-pyrimidin-4-yl)-methyl]-isophthalonitrile | HCID 59184754 | 43% |
Reaction Steps
5-Cyanomethyl-isophthalonitrile (0.285 g, 1.70 mmol) and 4-chloro-5-isopropyl-2,6-dimethoxy-pyrimidine (0.360 g, 1.66 mmol) was dissolved in DMF (8.0 mL) and cooled to 0° C. 60% Sodium hydride (0.136 g, 3.40 mmol) was added portionwise and the reaction was stirred at 0° C. for 2 h, then rt overnight. The reaction was quenched with saturated ammonium chloride solution and pH was adjusted to ˜6.0 with 1N HCl. Mixture was extracted with ethyl acetate and organic layer was dried (MgSO4) and concentrated. The resulting residue was purified by flash column chromatography (silica gel, 10 to 50% ethyl acetate/hexane) to give a white solid (0.2457 g, 43%). 1H NMR (300 MHz, CDCl3): δ 7.90 (s, 3H), 5.46 (s, 1H), 3.96 (s, 3H), 3.89 (s, 3H), 3.05-2.9 (m, 1H), 1.16 (d, J=6.9 Hz, 3H), 1.15 (d, J=7.2 Hz, 3H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08106064B2 |
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| Source dataset | uspto-grants-2012_01 |
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| ORD ID | ord-6fc24924f44c46e9b752ce10f90c2dc6 |
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| Source note | uspto-grants-2012_01 |
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