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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1847211Generated: October 31, 2026

3-Fluorobenzoic Acid → HCID 67254555, compound

https://huagongshe.com/reaction/1847211

Reaction equation

Participants

RoleNameHCIDCharge
Reactant3-Fluorobenzoic AcidHCID 9968—
ReactantPhenyl chloroformateHCID 15891—
Reactant2-Amino-4,6-dimethylpyridineHCID 21507—
ReactantSodium BicarbonateHCID 516892—
ReactantHCID 178505657HCID 178505657—
SolventTetrahydrofuranHCID 8028—
SolventTriethylamineHCID 8471—
ProductHCID 67254555HCID 67254555—

Reaction Steps

To a tetrahydrofuran (1 mL) solution of phenyl chloroformate (157 mg), a tetrahydrofuran (1 mL) solution of 6-amino-2,4-lutidine (122 mg) and triethylamine (0.14 mL) were added under ice cooling, followed by stirring for one hour. The resulting mixture was added to a tetrahydrofuran (0.5 mL) solution of 8-(3-fluorophenyl)-5,6,7,8-tetrahydro-1H-pyrido[4′,3′:4,5]pyrrolo[2,3-b]pyridine (prepared by conducting the operation having the same purpose as that in Example 8→Example 9→Example 10 using 3-fluorobenzoic acid in place of 3-methoxybenzoic acid) (60 mg) and triethylamine (31 μL), followed by stirring at 70° C. for 2 hours. To the reaction mixture, an aqueous saturated sodium hydrogen carbonate solution was added, followed by extraction with ethyl acetate. The organic layer was washed with an aqueous saturated sodium hydrogen carbonate solution and saturated saline, dried over anhydrous sodium sulfate and then concentrated. The residue was purified by silica gel column chromatography (parallel separation purification system) and recrystallized from a mixed solvent of ethyl acetate and hexane to obtain the titled compound having the following physical properties (38.7 mg).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08952158B2
Source datasetuspto-grants-2015_02
ORD IDord-6c26b8c0250c4257bcb303ffa8977e69
Source noteuspto-grants-2015_02