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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1526640Generated: November 3, 2026

Toluene → 4-Chloro-7-(trifluoromethyl)pyrido[3,2-d]pyrimidine

https://huagongshe.com/reaction/1526640

Reaction equation

Participants

RoleNameHCIDCharge
ReactantTolueneHCID 1140—
ReactantPhosphorus oxychlorideHCID 24813—
ReactantDiisopropylethylamineHCID 81531—
Reactant7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-4(3H)-oneHCID 135741650—
SolventWaterHCID 962—
SolventEthyl AcetateHCID 8857—
Product4-Chloro-7-(trifluoromethyl)pyrido[3,2-d]pyrimidineHCID 8672815896%

Reaction Conditions

Temperature115 °C

Reaction Steps

A pressure bottle was charged with 7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-4(3H)-one (540 mg, 2.51 mmol), toluene (10.000 mL) and Hunig's base (1.315 mL, 7.53 mmol). POCl3 (0.702 mL, 7.53 mmol) was added, and the bottle was sealed. The mixture was heated to 115° C. for 4 h. After cooling to RT, the mixture was diluted with EtOAc and water, and the layers were separated. The aqueous portion was extracted with additional EtOAc, and the combined organic portions were washed with saturated sodium bicarbonate, dried over sodium sulfate, filtered and concentrated. 4-chloro-7-(trifluoromethyl)pyrido[3,2-d]pyrimidine (560 mg, 2.397 mmol, 96% yield) was isolated as a brown solid. LC/MS (ESI+) m/z=234.0 (M+H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09085576B2
Source datasetuspto-grants-2015_07
ORD IDord-b0c7ba263df0470db305a01c3c161fd1
Source noteuspto-grants-2015_07