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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2298395Generated: October 31, 2026

Acetic Acid → HCID 53643628, compound

https://huagongshe.com/reaction/2298395

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 numberUS06492411B1
Source datasetuspto-grants-2002_12
ORD IDord-11658a66941f4d0182ee09cfcf2f649a
Source noteuspto-grants-2002_12