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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 448208Generated: October 29, 2026

Cesium carbonate → HCID 86665191, compound

https://huagongshe.com/reaction/448208

Reaction equation

Participants

RoleNameHCIDCharge
ReactantCesium carbonateHCID 10796—
ReactantSodium BromideHCID 253881—
ReactantSodium BicarbonateHCID 516892—
Reactant4-chloro-5H,6H,7H-pyrrolo[2,3-d]pyrimidin-6-oneHCID 12095870—
ReactantHCID 68749545HCID 68749545—
SolventDimethylformamideHCID 6228—
ProductHCID 86665191HCID 86665191—

Reaction Steps

To a solution of tert-butyl 5,6-bis(chloromethyl)pyridine-3-carboxylate (1.80 g, 6.52 mmol) in N,N-dimethylformamide (93.0 mL) was added 4-chloro-5,7-dihydro-6H-pyrrolo[2,3-d]pyrimidin-6-one (1.80 g, 10.62 mmol), cesium carbonate (3.65 g, 11.21 mmol), and sodium bromide (0.671 g, 6.52 mmol). After 30 min, saturated aqueous sodium bicarbonate was added and the mixture was washed with ethyl acetate (3×). The combined organics were washed with water (3×), brine (3×) and were dried with magnesium sulfate, filtered and concentrated. Purification by silica gel chromatography (100% dichloromethane→10% methanol/dichloromethane) then a second purification by silica gel chromatography (100% dichloromethane→30% ethyl acetate/dichloromethane) gave the title compound as a racemic mixture. Chiral separation of the individual enantiomers was accomplished by use of HPLC using a 10 cm ChiralPak® AD column (60% EtOH/hexanes with 0.1% diethylamine) to give the title compound as the 1st eluting enantiomer. MS: m/z=373.2 (M+1).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08481556B2
Source datasetuspto-grants-2013_07
ORD IDord-e9c11f4782934ea4a4314d49662c20c8
Source noteuspto-grants-2013_07