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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1626359Generated: November 1, 2026

tert-Butanol → Tert-butyl 5-(trifluoromethyl)thiophen-2-ylcarbamate

https://huagongshe.com/reaction/1626359

Reaction equation

Participants

RoleNameHCIDCharge
Reactanttert-ButanolHCID 6386—
ReactantTriethylamineHCID 8471—
ReactantP,P-Diphenylphosphinic azideHCID 199401—
Reactant5-(Trifluoromethyl)thiophene-2-carboxylic acidHCID 2049051—
ProductTert-butyl 5-(trifluoromethyl)thiophen-2-ylcarbamateHCID 86718387—

Reaction Conditions

Temperature90 °C

Reaction Steps

To 5-(trifluoromethyl)thiophene-2-carboxylic acid in tBuOH (50 mL) was added triethylamine (1.53 mL, 11 mmol) and diphenylphosphoryl azide (DPPA) (2.4 mL, 11 mmol). This mixture was heated to 90° C., and was stirred overnight (ca. 16 hours). Thin layer chromatography (TLC) indicated that the reaction was complete. The solvent was removed under reduced pressure, the residue was dissolved in ethyl acetate (EtOAc) and washed 1× with NaHCO3 aq sat, 1× with citric acid (10% aqueous), and 1× brine. The solution was dried over MgSO4, filtered and concentrated. After silica gel chromatography (5 to 20% EtOAc/hexanes) the title compound was afforded (1.46 g, 44% over 3 steps) as a yellow/orange solid, mp 118-120° C.; Rf=0.31 (10% EtOAc/hex); 1H NMR (DMSO-d6) δ 11.03 (br s, 1H), 7.38 (app d, 1H, J=4.1 Hz), 6.51 (app d, 1H, J=3.3 Hz), 1.49 (s, 9H); GCMS (EI) m/z 267 (M+).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08785465B2
Source datasetuspto-grants-2014_07
ORD IDord-3c16ecffdb9c493a83b3b0c28be9bf78
Source noteuspto-grants-2014_07