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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1589072Generated: October 25, 2026

Diisopropylamine → 2-[[(Phenylmethyl)thio]methyl]-4,4,4-trifluorobutyric acid

https://huagongshe.com/reaction/1589072

Reaction equation

Participants

RoleNameHCIDCharge
ReactantDiisopropylamineHCID 7912—
ReactantLithium diisopropylamideHCID 2724682—
Reactant4,4,4-Trifluorobutanoic acidHCID 2777085—
ReactantBenzylthiobromomethaneHCID 4067177—
ReactantHCID 178418244HCID 178418244—
SolventAcetic AcidHCID 176—
SolventTetrahydrofuranHCID 8028—
SolventEthyl AcetateHCID 8857—
Product2-[[(Phenylmethyl)thio]methyl]-4,4,4-trifluorobutyric acidHCID 19938461—

Reaction Conditions

Temperature0 °C

Reaction Steps

To a solution of lithium diisopropylamide [prepared using freshly distilled diisopropylamine (4.47 g., 44.4 mmol) and n-butyl lithium/hexane (18 mL, 45 mmol, 2.5M)] in dry tetrahydrofuran (35 mL) was added a solution of 4,4,4-trifluorobutyric acid (3.0 g., 21.0 mmol) in tetrahydrofuran (25 mL). After stirring at 0° C. for 1.5 hours, the solution was cooled to -78° C. and treated with a solution of benzyl bromomethyl thioether in tetrahydrofuran (10 mL). The solution was allowed to stir overnight as the temperature rose to ambient. Volatiles were removed in vacuo and the residue was dissolved in ethyl acetate and extracted with 1N sodium hydroxide (50 mL) and water (2×20 mL). The combined basic extracts were acidified with concentrated hydrochloric acid (8 mL) and extracted with ethyl acetate (2×100 mL). The organic extracts were washed with water and brine, combined, dried (MgSO4), and concentrated in vacuo to give 3.82 g. of an oil. Flash chromatography on 350 mL of silica gel and elution with ethyl acetate:hexanes:acetic acid, 50:100:1 gave 1.36 g. of the title A product, TLC Rf =0.38 (ethyl acetate:hexanes:acetic acid, 50:50:1).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS05223516
Source datasetuspto-grants-1993_06
ORD IDord-dbb8347112c14791b33949313751c3f5
Source noteuspto-grants-1993_06