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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1916660Generated: October 30, 2026

Ethyl 4-(4-bromo-phenylsulphanyl)-5-oxo-azepan-1-carboxylate → Ethyl 3-bromo-5,6,8,9-tetrahydro-10-thia-7-aza-benzo[a]azulen-7-carboxylate

https://huagongshe.com/reaction/1916660

Reaction equation

Participants

RoleNameHCIDCharge
ReactantEthyl 4-(4-bromo-phenylsulphanyl)-5-oxo-azepan-1-carboxylateHCID 69076506—
SolventWaterHCID 962—
ProductEthyl 3-bromo-5,6,8,9-tetrahydro-10-thia-7-aza-benzo[a]azulen-7-carboxylateHCID 69079455—

Reaction Steps

A solution of 44.3 g (119 mmol) ethyl 4-(4-bromo-phenylsulphanyl)-5-oxo-azepan-1-carboxylate in 443 g polyphosphoric acid is heated to 80° C. for 45 min and then diluted with 1000 mL water. The aqueous phase is extracted three times with chloroform. The organic phase is washed with water, dried over Na2SO4 and the solvent is eliminated i.vac. The purification is carried out by repeated column chromatography on silica gel (chloroform/EtOAc 19:1) and by recrystallisation from MeOH/acetone.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08618132B2
Source datasetuspto-grants-2013_12
ORD IDord-f88312fd1c9b41ddb9c8f10ce1e5bf40
Source noteuspto-grants-2013_12