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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1268568Generated: October 25, 2026

Methyl iodide → N-Boc-N-methyl-4-fluoro-D-phenylalanine

https://huagongshe.com/reaction/1268568

Reaction equation

Participants

RoleNameHCIDCharge
ReactantMethyl iodideHCID 6328—
ReactantEthyl AcetateHCID 8857—
ReactantSodium hydrideHCID 24758—
Reactant2-((tert-Butoxycarbonyl)amino)-3-(4-fluorophenyl)propanoic acidHCID 2756794—
SolventWaterHCID 962—
SolventTetrahydrofuranHCID 8028—
ProductN-Boc-N-methyl-4-fluoro-D-phenylalanineHCID 53833009—

Reaction Conditions

Temperature0 °C

Reaction Steps

2-tert-Butoxycarbonylamino-3-(4-fluorophenyl)propionic acid (5.0 g; 17.7 mmol) was dissolved in dry tetrahydrofuran. Iodomethane (8.8 mL; 141 mmol) was added and the reaction mixture was cooled to 0° C. Sodium hydride (2.1 g; 53.0 mmol) was slowly added and the reaction mixture was stirred for 12 hours at room temperature. Ethyl acetate (50 mL) was added and water (20 mL) was added dropwise to the reaction mixture. The ethyl acetate was removed in vacuo and the residue was diluted with diethyl ether (30 mL) and water (100 mL). The organic phase was extracted with a saturated aqueous solution of sodium hydrogen carbonate (50 mL). Citric acid (5%) was added to the combined aqueous phases until pH 3, which were then extracted with ethyl acetate (2×50 mL) and the phases were separated. The organic phase was washed with water (2×50 mL), an aqueous solution of sodium thiosulfate (5%; 2×50 mL) and water (50 mL) and dried (magnesium sulfate). The solvent was removed in vacuo and the residue was dissolved in diethyl ether (10 mL). Dicyclohexylamine (10 mL) was added. Methylene chloride (30 mL) was added and the mixture was heated until the precipitate was dissolved. Diethyl ether (20 mL) and heptane (20 mL) were added and the reaction mixture was left 12 hours without stirring. The reaction mixture was filtered to afford 5.7 g of (R)-2-(N-tert-butoxycarbonyl-N-methylamino)-3-(4-fluorophenyl)propionic acid as a dicyclohexylammonium salt.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS06555570B2
Source datasetuspto-grants-2003_04
ORD IDord-3416398c140548688c771151ee2b9cd3
Source noteuspto-grants-2003_04