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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1055059Generated: October 29, 2026

Sodium Hydroxide → HCID 71251340, compound

https://huagongshe.com/reaction/1055059

Reaction equation

Participants

RoleNameHCIDCharge
ReactantSodium HydroxideHCID 14798—
ReactantHCID 71251333HCID 71251333—
SolventMethanolHCID 887—
SolventTetrahydrofuranHCID 8028—
SolventEthyl AcetateHCID 8857—
SolventAmmonium ChlorideHCID 25517—
ProductHCID 71251340HCID 7125134088.5%

Reaction Conditions

Temperature50 °C

Reaction Steps

To a racemic solution of methyl 3-cyclobutyl-3-((5-fluoro-2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl)amino)propanoate (0.042 g, 0.109 mmol) in THF (1.5 mL) and MeOH (0.5 mL) was added NaOH (0.300 mL of 2 M solution, 0.600 mmol) and the reaction mixture was warmed to 50° C. After stirring the reaction mixture for 1 hour, the mixture was diluted with aqueous saturated NH4Cl solution and EtOAc. The organic layer was dried (MgSO4), filtered and evaporated to dryness to afford 36 mg of the desired product that was used without further purification: 1H NMR (400 MHz, d6-DMSO) δ 12.26 (s, 2H), 8.55 (d, J=9.7 Hz, 1H), 8.19 (dd, J=45.1, 15.8 Hz, 3H), 7.48 (d, J=8.1 Hz, 1H), 4.79 (s, 1H), 2.58 (dd, J=20.6, 12.2 Hz, 2H), 1.85 (ddd, J=29.4, 26.5, 21.1 Hz, 7H); LCMS Gradient 10-90%, 0.1% formic acid, 5 minutes, C18/ACN, RT=2.10 minutes (M+H) 374.02.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09394302B2
Source datasetuspto-grants-2016_07
ORD IDord-28b432b390b5465eabf57aa2a248a561
Source noteuspto-grants-2016_07