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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 38358Generated: October 29, 2026

Acetyl chloride → 1-[5-(2,4-Diamino-pyrimidin-5-yloxy)-4-isopropyl-2-methoxy-phenyl]-ethanone

https://huagongshe.com/reaction/38358

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetyl chlorideHCID 6367—
ReactantTrifluoroacetic acidHCID 6422—
ReactantAluminum(III) ChlorideHCID 6451240—
Reactant5-(4-Methoxy-2-(propan-2-yl)phenoxy)pyrimidine-2,4-diamineHCID 16117816—
SolventWaterHCID 962—
Solvent1,1-DichloroethaneHCID 6365—
Product1-[5-(2,4-Diamino-pyrimidin-5-yloxy)-4-isopropyl-2-methoxy-phenyl]-ethanoneHCID 5733007631%

Reaction Steps

5-(2-isopropyl-4-methoxy-phenoxy)-pyrimidine-2,4-diamine in anhydrous dichloroethane (20 mL) was added to trifluoroacetic acid (0.06 mL, 0.77 mmol), acetyl chloride (0.31 mL, 4.37 mmol), and aluminum trichloride (583 mg, 4.37 mmol). After stirring for 22 hours at room temperature, water (1.2 mL) was added to the reaction at 0° C. The mixture was dried using anhydrous sodium sulfate and concentrated in vacuo. Aqueous sodium hydroxide (0.2M, 10 mL) was added to the residue and the mixture was heated at 100° C. for 1 hour. After cooling, the reaction was extracted with dichloromethane. The dichloromethane layer was dried using anhydrous magnesium sulfate, concentrated, and purified with silica gel column chromatography eluting with 96/4/0.1 dichloromethane/methanol/ammonium hydroxide to yield 1-[5-(2,4-diamino-pyrimidin-5-yloxy)-4-isopropyl-2-methoxy-phenyl]-ethanone (72 mg, 31%) as off-white solid, MS (M+H)=317. Also recovered was 1-[5-(2,4-diamino-pyrimidin-5-yloxy)-2-hydroxy-4-isopropyl-phenyl]-ethanone (43 mg, 20%) as pale yellow solid, MS (M+H)=303.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08524725B2
Source datasetuspto-grants-2013_09
ORD IDord-88082ade4e2040a38e153ba3a6db0606
Source noteuspto-grants-2013_09