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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2199474Generated: October 26, 2026

Ammonia → (R)-2-hexyl-6-iodo-3,4-dihydronaphthalen-1(2H)-one

https://huagongshe.com/reaction/2199474

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAmmoniaHCID 222—
ReactantDiisopropylamineHCID 7912—
ReactantTetrahydrofuranHCID 8028—
Reactant1-IodohexaneHCID 12527—
Reactant(S)-N-(6-iodo-3,4-dihydronaphthalen-1(2H)-ylidene)-2-(methoxymethyl)pyrrolidin-1-amineHCID 86730041—
ReactantButyllithiumHCID 178418339—
SolventWaterHCID 962—
Product(R)-2-hexyl-6-iodo-3,4-dihydronaphthalen-1(2H)-oneHCID 86730042—

Reaction Conditions

Temperature0 °C

Reaction Steps

To a stirred solution of diisopropylamine (19.43 mL, 136 mmol) in anhydrous tetrahydrofuran (250 mL) was added butyl lithium solution (2.5 M in hexanes, 39.4 mL, 98 mmol) dropwise at 0° C. under nitrogen. The resulting solution was stirred at the same temperature for 15 min before a solution of (S)—N-(6-iodo-3,4-dihydronaphthalen-1(2H)-ylidene)-2-(methoxymethyl)pyrrolidin-1-amine (I-8B, 29.1 g, 76 mmol) in anhydrous tetrahydrofuran (100 mL) was added dropwise. The reaction solution was stirred at 0° C. for 2 h. A solution of 1-iodohexane (22.35 mL, 151 mmol) in tetrahydrofuran (50 mL) was added dropwise at −78° C. and the mixture was stirred at the same temperature for 2 h. The temperature was raised to room temperature over 1.5 h. The reaction mixture was quenched with saturated aqueous ammonium chloride solution (50 mL) and water (50 mL). The mixture was extracted with hexanes (200 mL) and ethyl acetate (3×50 mL). The combined extracts were dried over anhydrous sodium sulfate and concentrated under reduced pressure to give an oil. The oil was dissolved in THF (200 mL). A solution of cupric chloride, dihydrate (52 g) in water (220 mL) was added at 0° C. dropwise and the mixture was vigorously stirred at room temperature overnight. Aqueous ammonia solution was added to raise the pH to approximately 9. The mixture was extracted with hexane (100 mL) and diethyl ether (2×100 mL). The combined extracts were dried over anhydrous sodium sulfate and concentrated. Flash chromatography purification (330 g silica gel column, gradient elution from 0 to 15% EtOAc in hexanes) afforded (R)-2-hexyl-6-iodo-3,4-dihydronaphthalen-1(2H)-one (21.6 g, 60.6 mmol) as a white solid containing some of the (S) isomer, which was removed in the subsequent step. LC/MS M+1=357.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09359286B2
Source datasetuspto-grants-2016_06
ORD IDord-7d1dd80459f94f11ae4c9e20873a432c
Source noteuspto-grants-2016_06