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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1403968Generated: November 1, 2026

t-Butyl bromide → 3-(tert-Butyl)-6-nitro-1h-indole

https://huagongshe.com/reaction/1403968

Reaction equation

Participants

RoleNameHCIDCharge
Reactantt-Butyl bromideHCID 10485—
Reactant6-Nitro-1H-indoleHCID 78502—
ReactantDiisopropylethylamineHCID 81531—
CatalystTetrabutylammonium IodideHCID 67553—
CatalystZinc trifluoromethanesulfonateHCID 104671—
SolventTolueneHCID 1140—
Product3-(tert-Butyl)-6-nitro-1h-indoleHCID 5747019822%

Reaction Conditions

Temperature120 °C

Reaction Steps

To a mixture of 6-nitroindole (1.0 g, 6.2 mmol), zinc triflate (2.1 g, 5.7 mmol), and TBAI (1.7 g, 5.2 mmol) in anhydrous toluene (11 mL) was added DIEA (1.5 g, 11 mmol) at room temperature under nitrogen. The reaction mixture was stirred for 10 min at 120° C., followed by the addition of t-butyl bromide (0.71 g, 5.2 mmol). The resulting mixture was stirred for 45 min at 120° C. The solid was filtered off and the filtrate was concentrated to dryness. The residue was purified by column chromatography on silica gel (petroleum ether/ethyl acetate=20:1) to give 3-tert-butyl-6-nitro-1H-indole (0.25 g, 19%) as a yellow solid. 1H-NMR (CDCl3) δ 8.32 (d, J=2.1 Hz, 1H), 8.00 (dd, J=2.1, 14.4 Hz, 1H), 7.85 (d, J=8.7 Hz, 1H), 7.25 (s, 1H), 1.46 (s, 9H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08912199B2
Source datasetuspto-grants-2014_12
ORD IDord-78cc1aef1d4e422dbce06a68035fc737
Source noteuspto-grants-2014_12