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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2365786Generated: October 30, 2026

Sodium Carbonate → 4-(2-Fluoropyridin-4-yl)-2-(methylthio)pyrimidine

https://huagongshe.com/reaction/2365786

Reaction equation

Participants

RoleNameHCIDCharge
ReactantSodium CarbonateHCID 10340—
Reactant2-Fluoropyridine-4-boronic acidHCID 2783396—
Reactant4-Bromo-2-(methylsulfanyl)pyrimidineHCID 45787531—
CatalystHCID 178418807HCID 178418807—
Solvent1,4-Dioxane--water (1/1)HCID 21886435—
Product4-(2-Fluoropyridin-4-yl)-2-(methylthio)pyrimidineHCID 8669664590.5%

Reaction Conditions

Temperature85 °C

Reaction Steps

A suspension of 4-bromo-2-(methylthio)pyrimidine (7.00 g, 34.1 mmol), 2-fluoropyridin-4-ylboronic acid (5.05 g, 35.8 mmol), Na2CO3 (10.9 g, 102 mmol) and Pd(dppf)Cl2 CH2Cl2 (1.40 g, 1.71 mmol) in dioxane/H2O (100 mL; 1:1) was heated to 85° C. under an Ar balloon for 2 hours. The reaction mixture was cooled to room temperature and concentrated. The residue was diluted with ethyl acetate (200 mL) and water (100 mL). The layers were separated, and the aqueous layer was extracted with ethyl acetate (1×). The organics were dried, filtered and concentrated. The crude product was purified via column chromatography, eluting with hexanes/ethyl acetate (3:1) to give 4-(2-fluoropyridin-4-yl)-2-(methylthio)pyrimidine (6.83 g, 90%) as a solid. 1H NMR (400 MHz, (CD3)2SO) δ 8.85 (d, J=5.2 Hz, 1H), 8.46 (d, J=5.2 Hz, 1H), 8.11 (m, 1H), 7.96 (d, J=5.2 Hz, 1H), 7.92 (s, 1H), 2.62 (s, 3H); m/z (APCI-pos) M+1=222.1.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08697715B2
Source datasetuspto-grants-2014_04
ORD IDord-221da00f234749559cc3ab26fb5504a5
Source noteuspto-grants-2014_04