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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 844549Generated: October 29, 2026

Iodine → HCID 22613825, compound

https://huagongshe.com/reaction/844549

Reaction equation

Participants

RoleNameHCIDCharge
ReactantIodineHCID 807—
ReactantAmmonium ChlorideHCID 25517—
ReactantBenzene, 1-bromo-3,5-dimethyl-HCID 136357—
ReactantEthyl 2-(1-benzylpiperidin-4-ylidene)-2-cyanoacetateHCID 424752—
ReactantMagnesiumHCID 5462224—
SolventDiethyl EtherHCID 3283—
SolventTetrahydrofuranHCID 8028—
ProductHCID 22613825HCID 2261382542.8%

Reaction Conditions

Temperature0 °C

Reaction Steps

1,3-Dimethyl-5-bromobenzene (15.6 g) was dissolved in anhydrous diethyl ether (60 ml) and added to a vigorously stirred mixture of magnesium turnings (2.2 g) and 2-3 iodine crystals under a nitrogen atmosphere. Gentle heating was applied to initiate formation of the Grignard reagent and once the spontaneous refluxing had subsided the mixture was heated under reflux for a further 30 minutes. The mixture was cooled in an ice-bath and a solution of ethyl 2-(1-benzylpiperidin-4-ylidene)-2-cyanoacetate (8.0 g) (see Preparation 2) in anhydrous tetrahydrofuran (80 ml) added over 20 minutes. The mixture was stirred at 0° C. for 15 minutes before being left to stand at room temperature for 3 days. The mixture was then poured into saturated aqueous ammonium chloride solution (300 ml) and extracted twice with diethyl ether. The organic extracts were combined and the solvent removed under reduced pressure to give a residue which was chromatographed on silca gel eluting with a solvent gradient of 3:0 changing to 3:1, by volume, dichloromethane:diethyl ether to give the title compound (4.7 g) as an oil.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS06380396B1
Source datasetuspto-grants-2002_04
ORD IDord-984d0f49ed5b469ba473706163420b94
Source noteuspto-grants-2002_04