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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2093579Generated: October 30, 2026

Acetic Acid → Benzonitrile, 3-bromo-4-hydroxy-5-nitro-

https://huagongshe.com/reaction/2093579

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetic AcidHCID 176—
ReactantWaterHCID 962—
ReactantBromoxynilHCID 15531—
ReactantSodium NitriteHCID 23668193—
SolventEthyl AcetateHCID 8857—
ProductBenzonitrile, 3-bromo-4-hydroxy-5-nitro-HCID 3014048116.2%

Reaction Conditions

Temperature50 °C

Reaction Steps

To a 5-l, 3-neck round-bottom flask fitted with a thermocouple, stirring paddle, and nitrogen line were added 3,5-dibromo-4-hydroxybenzonitrile (95 g) and glacial acetic acid (3.3 l). Sodium nitrite (120 g) was then added in small portions. The mixture was heated to 50° C. and stirred overnight at this temperature. The mixture was then allowed to cool and poured into a large extractor containing water (10 l). ethyl acetate (10 l) was added and the layers were separated. The aqueous layer was extracted with ethyl acetate (4 l) and the combined organic layers were washed with water and brine, and then dried over magnesium sulfate and concentrated in vacuo to provide 96.9 g of the desired product. Mass spectrum (ESI) 243.0 (M+).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08445480B2
Source datasetuspto-grants-2013_05
ORD IDord-cf801827d007468488777d1961e1eaae
Source noteuspto-grants-2013_05