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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 533809Generated: October 28, 2026

3-Bromothiophene → 1-Butyl-4-[hydroxy(di-3-thienyl)methyl]-1-azoniabicyclo[2.2.2]octane bromide

https://huagongshe.com/reaction/533809

Reaction equation

Participants

RoleNameHCIDCharge
Reactant3-BromothiopheneHCID 13383—
ReactantEthyl 1-azabicyclo(2.2.2)octane-4-carboxylateHCID 573424—
ReactantButyllithiumHCID 178418339—
SolventDimethyl SulfoxideHCID 679—
SolventDiethyl EtherHCID 3283—
SolventEther tetrahydrofuranHCID 21868444—
Product1-Butyl-4-[hydroxy(di-3-thienyl)methyl]-1-azoniabicyclo[2.2.2]octane bromideHCID 689654499.4%

Reaction Steps

A solution of n-Butyl lithium (2.5M in hexanes, 5.0 mL, 12.5 mmol) was chilled to −78° C. under Ar. 3-Bromothiophene (1.15 mL, 12.3 mmol) dissolved in ethyl ether (4.0 mL) was slowly added to the reaction mixture. The reaction was stirred for 30 min and then ethyl 1-azabicyclo[2.2.2]octane-4-carboxylate (0.7640 g, 4.16 mmol) in THF/Et2O (4 mL/4 mL) was added. The reaction was allowed to warm up from −78° C. to room temperature over 16 h then slowly quenched with water. The reaction was concentrated and the resulting brown solid was taken up in water and DCM. The organic phase was separated, dried over MgSO4, filtered and concentrated under vacuum to give a brown solid. The solid was dissolved in DMSO and purified by preparatory HPLC to give the title compound (0.1736 g, 9.4%). EI-MS m/z 362(M+) Rt (1.73 min).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08853404B2
Source datasetuspto-grants-2014_10
ORD IDord-d04e07a3a56f4fd3a224f349e3b9ca36
Source noteuspto-grants-2014_10