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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 474105Generated: November 4, 2026

Hydrochloric Acid → (R)-2-[(R)-2-(6-Bromo-3-fluoro-pyridin-2-yl)-2-(4-nitro-benzenesulfonylamino)-propoxy]-3,3,3-trifluoro-2-methyl-propionic acid ethyl ester

https://huagongshe.com/reaction/474105

Reaction equation

Participants

RoleNameHCIDCharge
ReactantHydrochloric AcidHCID 313—
ReactantPotassium tert-butoxideHCID 23665647—
Reactant(R)-3,3,3-trifluoro-2-hydroxy-2-methyl-propionic acid ethyl esterHCID 26985621—
ReactantHCID 178421671HCID 178421671—
SolventDimethylformamideHCID 6228—
Solventtert-Butyl methyl etherHCID 15413—
SolventSodium chloride; waterHCID 57417360—
Product(R)-2-[(R)-2-(6-Bromo-3-fluoro-pyridin-2-yl)-2-(4-nitro-benzenesulfonylamino)-propoxy]-3,3,3-trifluoro-2-methyl-propionic acid ethyl esterHCID 8666807665.8%

Reaction Steps

A solution of (R)-3,3,3-trifluoro-2-hydroxy-2-methyl-propionic acid ethyl ester (11.93 g, 64.1 mmol) in DMF (158 ml) was evacuated/flushed with nitrogen twice. A solution of KOtBu (6.21 g, 55.5 mmol) in DMF (17 ml) was added in a dropwise while maintaining a reaction temperature of ca 25° C. using cooling with a water bath. After 15 min solid 6-bromo-3-fluoro-2-[(S)-2-methyl-1-(4-nitro-benzenesulfonyl)-aziridin-2-yl]-pyridine (17.78 g, 42.7 mmol) was added and stirring was continued for 3 h. The reaction mixture was poured onto a mixture of 1M HCl (56 ml), brine and TBME. The layers were separated, washed with brine and TBME. The combined organic layers were dried over MgSO4.H2O, filtered and evaporated. The crude reaction product was purified via chromatography on silica gel (hexanes/25-33% TBME) to yield 16.93 g of the title compound as a yellow resin that was contaminated with an isomeric side-product (ratio 70:30 by 1H-NMR).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08637508B2
Source datasetuspto-grants-2014_01
ORD IDord-cc02c681880547399a0ba0ca18075b1e
Source noteuspto-grants-2014_01