Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 36502Generated: October 26, 2026

L-Aspartic Acid → N-[2-[(Acetylthio)methyl]-3,3,3-trifluoro-1-oxopropyl]-L-aspartic acid

https://huagongshe.com/reaction/36502

Reaction equation

Participants

RoleNameHCIDCharge
ReactantL-Aspartic AcidHCID 5960—
ReactantDimethylformamideHCID 6228—
ReactantN,N-Bis(trimethylsilyl)trifluoroacetamideHCID 65279—
Reactant2-Trifluoromethyl-3-acetylthiopropionyl chlorideHCID 54308536—
SolventAcetonitrileHCID 6342—
ProductN-[2-[(Acetylthio)methyl]-3,3,3-trifluoro-1-oxopropyl]-L-aspartic acidHCID 53692834—

Reaction Conditions

Temperature0 °C

Reaction Steps

A stirred suspension of L-aspartic acid (2.66 g., 20 mmol.) in 35 mL of dry acetonitrile under argon was cooled to 0° C. and bis(trimethylsilyl)trifluoroacetamide (10.62 mL, 40 mmol) was added. The reaction mixture was allowed to stir and gradually warmed to room temperature overnight, and then 5 mL of dimethylformamide was added and the mixture was stirred for 2 hours. The resultant clear, light yellow solution was cooled to 5° C. and 2-trifluoromethyl-3-acetylthiopropionyl chloride (4.69 g., 20 mmol), dissolved in 6 mL of acetonitrile, was added dropwise. The reaction mixture was allowed to stir and warm to room temperature overnight, and then the solvent was evaporated. The yellow syrupy residue was partitioned between water (50 mL) and ethyl acetate (50 mL), and the organic layer was separated. The aqueous phase was further extracted with ethyl acetate (3×50 mL) and the combined ethyl acetate extract was washed with brine, dried (MgSO4) and evaporated to yield 12.2 g. of a light yellow residue. Flash chromatography on silica gel (125:1 silica gel to compound) eluting with ethyl acetate:acetic acid, 15:1 gave 5.25 g. of a major fraction which was a light yellow sticky solid and 0.63 g. fraction which was nearly homogeneous by TLC, for a total of 5.88 g. of the title compound as a mixture of diastereomers.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS05414013
Source datasetuspto-grants-1995_05
ORD IDord-ca9ab82f383246dbada7d44138183f0d
Source noteuspto-grants-1995_05