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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 551045Generated: October 30, 2026

Butanoic acid, 4-chloro-4-oxo-, ethyl ester → HCID 57426203, compound

https://huagongshe.com/reaction/551045

Reaction equation

Participants

RoleNameHCIDCharge
ReactantButanoic acid, 4-chloro-4-oxo-, ethyl esterHCID 84648—
Reactant4-Nitro-1H-indoleHCID 145766—
ReactantDimethylalumanylium chlorideHCID 16686359—
SolventDichloromethaneHCID 6344—
ProductHCID 57426203HCID 57426203—

Reaction Steps

To a stirred solution of 4-nitroindole (2.00 g, 12.3 mmol) in CH2Cl2 (60 mL) at 0° C. was added dimethylaluminum chloride (1 M in hexanes, 14.8 mL, 14.8 mmol) and the mixture was stirred for 30 min. Ethyl 4-chloro-4-oxobutyrate (2.44 g, 14.8 mmol) was added dropwise and the resulting mixture was allowed to warm slowly to ambient temperature and stirred for 18 h. The reaction mixture was carefully quenched with 10% aqueous citric acid (150 mL) and extracted with CH2Cl2 (3×150 mL). The combined organic extracts were dried over Na2SO4, filtered, and concentrated in vacuo. The residue was partially purified by silica gel chromatography, eluting with a gradient of CH2Cl2:EtOAc—100:0 to 65:35, and the resulting crude product was recrystallized from CH2Cl2:MeOH to give the title compound. MS: m/z=291 (M+1).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07947677B2
Source datasetuspto-grants-2011_05
ORD IDord-aa272e042d5e489ebb097657be1a3278
Source noteuspto-grants-2011_05