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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1770869Generated: October 31, 2026

2,4-Dichloro-5-fluoropyrimidine → 2-chloro-5-fluoro-N4-[4-(prop-2-ynyloxy)phenyl]-4-pyrimidineamine

https://huagongshe.com/reaction/1770869

Reaction equation

Participants

RoleNameHCIDCharge
Reactant2,4-Dichloro-5-fluoropyrimidineHCID 250705—
Reactant4-(Prop-2-yn-1-yloxy)anilineHCID 12668862—
SolventEthyl AcetateHCID 8857—
SolventMethanol--water (1/1)HCID 22242641—
Product2-chloro-5-fluoro-N4-[4-(prop-2-ynyloxy)phenyl]-4-pyrimidineamineHCID 57562899243.6%

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

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09248190B2
Source datasetuspto-grants-2016_02
ORD IDord-3f8d65a54c304542a525ed1e5513c679
Source noteuspto-grants-2016_02