HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 605881Generated: October 27, 2026
2,4-Dichloro-5-fluoropyrimidine → 2-chloro-5-fluoro-N4-[4-(prop-2-ynyloxy)phenyl]-4-pyrimidineamine
https://huagongshe.com/reaction/605881
Participants
| Role | Name | HCID | Charge |
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| Reactant | 2,4-Dichloro-5-fluoropyrimidine | HCID 250705 | — |
| Reactant | 4-(Prop-2-yn-1-yloxy)aniline | HCID 12668862 | — |
| Solvent | Ethyl Acetate | HCID 8857 | — |
| Solvent | Methanol--water (1/1) | HCID 22242641 | — |
| Product | 2-chloro-5-fluoro-N4-[4-(prop-2-ynyloxy)phenyl]-4-pyrimidineamine | HCID 57562899 | 243.6% |
Reaction Steps
Crude 4-(prop-2-ynyloxy)aniline (0.750 g, 5.10 mmol) and 2,4-dichloro-5-fluoropyrimidine (1.27 g, 0.760 mmol) were stirred in MeOH/water (4:1, 35 mL) at room temperature for 18 h. The reaction mixture was diluted with EtOAc (200 mL) and washed with 1N HCl (50 mL) and brine (50 mL). The organic layer was dried (MgSO4), filtered and concentrated in vacuo. The residue was purified by column chromatography (silica gel, hexanes ramped to EtOAc:hexanes (1:10)) to provide 2-chloro-5-fluoro-N4-[4-(prop-2-ynyloxy)phenyl]-4-pyrimidineamine as a light brown solid (0.514 g). 1H NMR (CDCl3): δ 8.03 (d, J=2.7 Hz, 1H), 7.53 (d, J=8.7 Hz, 2H), 7.02 (d, J=8.7 Hz, 2H), 6.86 (s, 1H), 4.71 (d, J=2.4 Hz, 2H), 2.55 (t, J=2.4 Hz, 1H); LCMS: purity: 99%; MS (m/e): 279 (MH+).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US07915273B2 |
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| Source dataset | uspto-grants-2011_03 |
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| ORD ID | ord-ceb45e435ce34acd99ba8ed4e2c6a205 |
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| Source note | uspto-grants-2011_03 |
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