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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1889646Generated: October 30, 2026

Water → HCID 66616501, compound

https://huagongshe.com/reaction/1889646

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
Reactant4-FluorobenzylamineHCID 67326—
Reactant1-HydroxybenzotriazoleHCID 75771—
ReactantSodium BicarbonateHCID 516892—
Reactant1,3-Propanediamine, N'-(ethylcarbonimidoyl)-N,N-dimethyl-, monohydrochlorideHCID 2723939—
ReactantHCID 66616348HCID 66616348—
SolventEthyl AcetateHCID 8857—
Solventdichloromethane N,N-dimethylformamideHCID 22350042—
ProductHCID 66616501HCID 6661650190%

Reaction Steps

To a solution of 3-(4-fluorophenoxy)-5-(methoxycarbonyl)benzoic acid (2.2 g, 7.58 mmol) in DMF/CH2Cl2 at rt was added EDCI.HCl (1.889 g, 9.85 mmol) followed by HOBt.H2O (1.024 g, 7.58 mmol) with stirring. After one minute (4-fluorophenyl)methanamine (0.949 g, 7.58 mmol) was added to the mixture and it was stirred at rt for 4 h. EtOAc and aq NaHCO3 were added to the mixture. The EtOAc layer was separated, washed with water, dried over MgSO4 and concentrated in vacuo to obtain a crude product (2.7 g, 6.79 mmol, 90% yield) as a light yellow solid. The crude product was used in the next step without further purification. MS (ESI): (M+H)+=382.21.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08501992B2
Source datasetuspto-grants-2013_08
ORD IDord-a1fe1915c113447ab046af2496f4bb82
Source noteuspto-grants-2013_08