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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1749574Generated: October 27, 2026

Water → 6-bromo-2-isopropyl-4-nitro-1H-benzo[d]imidazole

https://huagongshe.com/reaction/1749574

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantIsobutyric AcidHCID 6590—
ReactantSodium CarbonateHCID 10340—
Reactant5-Bromo-3-nitrobenzene-1,2-diamineHCID 45789403—
Product6-bromo-2-isopropyl-4-nitro-1H-benzo[d]imidazoleHCID 6697672577%

Reaction Conditions

Temperature120 °C

Reaction Steps

A mixture of 5-bromo-3-nitrobenzene-1,2-diamine (prepared following the same procedure as for Example 1, 5.0 g) in isobutyric acid (20 mL) was stirred at 120° C. overnight. The mixture was cooled to room temperature and poured into water (100 mL). The pH was neutralized with aqueous Na2CO3 solution. It was then extracted with EtOAc and the organic layer was washed with water and brine, dried over anhydrous MgSO4, filtered and concentrated in-vacuo. The residue was then purified by silica gel chromatography eluted with EtOAc:petroleum ether=1:1 to afford the desired product as a yellow solid (4.7 g, 77%). 1H NMR (300 MHz, CDCl3) δ ppm 1.51 (m, 6H, J=6.9 Hz), 3.32 (m, 1H, J=6.9 Hz), 8.16 (d, 1H, J=1.5 Hz), 8.25 (d, 1H, J=1.5 Hz), 10.26 (br s, 1H); LC-MS: m/e=284 [M+1]+

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09156797B2
Source datasetuspto-grants-2015_10
ORD IDord-da75a850df1d489a97b26c66370a54d0
Source noteuspto-grants-2015_10