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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1941700Generated: November 3, 2026

Acetic Acid → HCID 53643628, compound

https://huagongshe.com/reaction/1941700

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetic AcidHCID 176—
ReactantEthyl cyanoacetateHCID 7764—
ReactantAmmonium AcetateHCID 517165—
ReactantHCID 12082818HCID 12082818—
SolventBenzeneHCID 241—
ProductHCID 53643628HCID 5364362866%

Reaction Steps

To a solution of the aldehyde from Step 1 (1.2 g, 3.6 mmol) in benzene (18 mL) was added ethyl cyanoacetate (0.38 mL, 3.6 mmol), ammonium acetate (50 mg, 0.7 mmol) and glacial acetic acid (0.17 mL, 2.8 mmol). The solution was heated at reflux for 18 hours, cooled, and partitioned between water and ethyl acetate. The organic solution was washed with a saturated aqueous sodium bicarbonate solution, water and brine. The organic solution was dried and concentrated. The residue was chromatographed on silica (40% hexane in ethyl acetate) to give the desired product (1.0 g, 66%): Anal. calc'd for C21H18N4O4S: C, 59.82; H, 4.30; N, 13.22. Found: C, 59.70; H, 4.29; N, 13.26.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUSRE044048E1
Source datasetuspto-grants-2013_03
ORD IDord-1fb7f37e72fe463d8aefb385fd83e180
Source noteuspto-grants-2013_03