Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1895116Generated: October 26, 2026

Hydrochloric Acid → HCID 178496278, compound

https://huagongshe.com/reaction/1895116

Reaction equation

Participants

RoleNameHCIDCharge
ReactantHydrochloric AcidHCID 313—
ReactantMethyl 4-methoxyacetoacetateHCID 123500—
Reactant2-Fluoro-4-iodoanilineHCID 185694—
ReactantSodium AcetateHCID 517045—
ReactantSodium NitriteHCID 23668193—
SolventMethanolHCID 887—
SolventWaterHCID 962—
ProductHCID 178496278HCID 17849627880%

Reaction Conditions

Temperature0 °C

Reaction Steps

A solution of NaNO2 (1.66 g, 24 mmol) in H2O (5 mL) was added dropwise at 0° C. to a mixture of 2-fluoro-4-iodoaniline (4.74 g, 20 mmol) and 6 M HCl aqueous solution (20 mL, 120 mmol). After stirring for 15 min, the resulting aqueous solution was added to a suspension of methyl 4-methoxyacetoacetate (2.59 mL, 20 mmol) and NaOAc (9.84 g, 120 mmol) in MeOH (40 mL) pre-cooled at 0° C. The reaction mixture was poured into water and extracted with AcOEt. The extract was washed with saturated NaHCO3 aqueous solution and brine, dried over MgSO4, and concentrated under reduced pressure. The residue was recrystallized from hexane/AcOEt to give the title compound (6.29 g, 80% yield) as yellow crystals: mp 141-146° C.; 1H NMR (300 MHz, CDCl3): δ ppm 3.50 (3H, s), 3.93 (3H, s), 4.64 (2H, s), 7.35 (1H, t, J=8.5 Hz), 7.49-7.55 (2H, m), 12.97 (1H, br s). Anal. Calcd for C12H12FIN2O4: C, 36.57; H, 3.07; N, 7.11. Found: C, 36.74; H, 3.10; N, 7.32.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08513251B2
Source datasetuspto-grants-2013_08
ORD IDord-ebfed1074bf54762ba1aeaa249e37420
Source noteuspto-grants-2013_08