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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 603139Generated: November 1, 2026

Dimethylformamide → 4-(1-Cyano-1-methylethyl)benzonitrile

https://huagongshe.com/reaction/603139

Reaction equation

Participants

RoleNameHCIDCharge
ReactantDimethylformamideHCID 6228—
Reactant2-Methyl-2-(4-methylphenyl)propanenitrileHCID 12369083—
CatalystZinc cyanide (Zn(CN)2)HCID 11186—
CatalystHCID 178418397HCID 178418397—
SolventWaterHCID 962—
Product4-(1-Cyano-1-methylethyl)benzonitrileHCID 1017631485%

Reaction Conditions

Temperature100 °C

Reaction Steps

2-methyl-2-(4-methylphenyl)propanenitrile (3.51 g, 15.7 mmol) is dissolved in dry DMF (10 mL). Zn(CN)2 (2.02 g, 17.2 mmol) and Pd(PPh3)4 (906 mg, 5 mol %) are added and the mixture heated at 100° C. for 3 hours. The reaction mixture is diluted with water and the solid recovered by filtration. The solid residue is dissolved in methanol, filtered to remove insoluble impurities, concentrated under vacuo and purified by normal phase MPLC (SiO2, hexane to EtOAc), giving 4-(1-cyano-1-methylethyl)benzonitrile (2.28 g, 13.4 mmol, 85%) as a white solid. 1H NMR (400 MHz, DMSO-D6) δ ppm 1.70 (s, 6H) 7.73 (dt, J=8.64, 2.03 Hz, 2H) 7.92 (dt, J=8.69, 2.00 Hz, 2H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07906654B2
Source datasetuspto-grants-2011_03
ORD IDord-17235208c33a46dcaa7e41e12a4fece2
Source noteuspto-grants-2011_03