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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 448218Generated: October 30, 2026

Acetic Acid → tert-Butyl [(3S,5S,6R)-6-methyl-5-(2-methylphenyl)-2-oxo-1-(2,2,2-trifluoroethyl)piperidin-3-yl]carbamate

https://huagongshe.com/reaction/448218

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetic AcidHCID 176—
ReactantEthanamine, 2,2,2-trifluoro-HCID 9773—
ReactantPotassium CarbonateHCID 11430—
ReactantSodium triacetoxyborohydrideHCID 5049666—
ReactantMethyl N-(tert-butoxycarbonyl)-4-(2-methylphenyl)-5-oxonorleucinateHCID 68749380—
SolventEthanolHCID 702—
SolventWaterHCID 962—
Solvent1,1-DichloroethaneHCID 6365—
Producttert-Butyl [(3S,5S,6R)-6-methyl-5-(2-methylphenyl)-2-oxo-1-(2,2,2-trifluoroethyl)piperidin-3-yl]carbamateHCID 86665196—

Reaction Conditions

Temperature23 °C

Reaction Steps

To a solution of methyl N-(tert-butoxycarbonyl)-4-(2-methylphenyl)-5-oxonorleucinate (1.60 g, 4.58 mmol) in dichloroethane (23 mL) were added glacial acetic acid (0.524 mL, 9.16 mmol), 2,2,2-trifluoroethylamine (1.83 mL, 22.9 mmol) and 4 {acute over (Å)} molecular sieves (500 mg). The mixture was stirred at 23° C. for 20 min and then sodium triacetoxyborohydride (4.85 g, 22.89 mmol) was added. The mixture was stirred at 23° C. for 18 h. The mixture was diluted with water and extracted with ethyl acetate (3×). Molecular sieves were removed by filtration and the combined organic extracts were washed with water, brine, dried over sodium sulfate, filtered and concentrated. A solution of the residue in ethanol (45 mL) was stirred in the presence of solid potassium carbonate (1.86 g, 13.49 mmol) at 60° C. for 2 h. The bulk of the ethanol was removed under reduced pressure and the remaining slurry was then partitioned between water (25 mL) and ethyl acetate (150 mL). The organic layer was washed with brine, dried over sodium sulfate and concentrated. Purification by silica gel chromatography (5% ethyl acetate→50% ethyl acetate/hexane) was followed by separation of the enantiomers using normal-phase HPLC using a ChiralPak® AD column, eluting with 20% hexane in ethanol (0.1% diethylamine used as a modifier) to afford the title compound as the second enantiomer to elute. MS: m/z=423.2 (M+Na).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08481556B2
Source datasetuspto-grants-2013_07
ORD IDord-e5451594b9394fea849f571b9b61900d
Source noteuspto-grants-2013_07