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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1191905Generated: November 2, 2026

Sodium Iodide → HCID 59212626, compound

https://huagongshe.com/reaction/1191905

Reaction equation

Participants

RoleNameHCIDCharge
ReactantSodium IodideHCID 5238—
ReactantTriethylamineHCID 8471—
Reactant(S)-1-Boc-3-methylpiperazineHCID 7023035—
Reactant5-bromo-2,3-dihydro-1H-inden-1-olHCID 13486299—
SolventWaterHCID 962—
SolventThionyl ChlorideHCID 24386—
ProductHCID 59212626HCID 59212626—

Reaction Steps

5-Bromo-1-indanol (1.0 g, 4.7 mmol) of Step A was dissolved in thionyl chloride (10 mL). After stirring at room temperature for 2 hrs, the solution was concentrated under vacuum. The residue was taken up in DMF (10 mL). To the mixture were added tert-butyl (3S)-3-methylpiperazine-1-carboxylate (0.94 g, 4.7 mmol), NaI (2 g, 13 mmol) and triethylamine (1.5 mL, 10 mmol). The resulting solution was stirred at 70° C. overnight. After cooling to room temperature, water was added. The solution was extracted with EtOAc twice. The combined EtOAc layers were washed with brine, dried over MgSO4 and concentrated. Column chromatography on silica (50% EtOAc in hexane) provided two isomers. Isomer 1 (fast moving isomer): 0.36 g; MS calculated for C19H27BrN2O2 (M+H)+ 395. found 395.1, 397.0. Isomer 2 (slow moving isomer): 0.33 g; MS found 395.1, 397.0.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08680104B2
Source datasetuspto-grants-2014_03
ORD IDord-f47cca530770497bbe1a517c350e5630
Source noteuspto-grants-2014_03