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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1797046Generated: November 3, 2026

Pyridinium, 1-amino-, iodide (1:1) → HCID 21948674, compound

https://huagongshe.com/reaction/1797046

Reaction equation

Participants

RoleNameHCIDCharge
ReactantPyridinium, 1-amino-, iodide (1:1)HCID 2733704—
Reactant2-Propynoic acid, 3-(4-fluorophenyl)-, methyl esterHCID 11126821—
Reactant1,8-Diazabicycloundec-7eneHCID 129662960—
SolventAcetonitrileHCID 6342—
ProductHCID 21948674HCID 21948674—

Reaction Steps

A stirred solution of methyl 3-(4-fluorophenyl)propiolate (8.02 g, 45 mmol) and 1-aminopyridinium iodide (10 g, 45 mmol) in dry acetonitrile (150 mL) was cooled to about 0° C. A solution of 1,8-diazabicycloundec-7-ene (13.7 g, 90 mmol) in dry acetonitrile (50 mL) was added dropwise over 1 hour. The mixture was allowed to stir at room temperature for about 18 h. The reaction mixture was cooled in an ice bath for about 30 minutes and the precipitate was collected by filtration and washed with cold acetonitrile (10 mL). The solid was dried under reduced pressure to give the title compound as a white solid, 8.48 g (70%). 1H NMR (CDCl3) δ 8.50 (d, 1H, J=8.4 Hz), 8.18 (d, 1H, J=8.8 Hz), 7.78 (m, 2H), 7.42 (t, 1H, J=8.4 Hz), 7.13 (t, 2H, J=8.8 Hz), 6.97 (td, 1H, J=6.8, 1 Hz).). MS (+ve ion electrospray) 271 (100), (MH+).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07034030B2
Source datasetuspto-grants-2006_04
ORD IDord-cfae8f2f7b8a45af9859f6b5f64c45d3
Source noteuspto-grants-2006_04