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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 535027Generated: October 25, 2026

tert-Butyl piperazine-1-carboxylate → Tert-butyl 4-(4-cyano-2-methylphenyl)piperazine-1-carboxylate

https://huagongshe.com/reaction/535027

Reaction equation

Participants

RoleNameHCIDCharge
Reactanttert-Butyl piperazine-1-carboxylateHCID 143452—
Reactant4-Bromo-3-methylbenzonitrileHCID 2737494—
CatalystFerrocene-1,1'-bis-(diphenylphosphine)HCID 635956—
SolventTetrahydrofuranHCID 8028—
ProductTert-butyl 4-(4-cyano-2-methylphenyl)piperazine-1-carboxylateHCID 6005111186.9%

Reaction Steps

Part 4: To a nitrogen flushed flask containing PdCl2dppf (65.8 mg, 0.081 mmol), dppf (44.6 mg, 0.081 mmol) and 4-bromo-3-methylbenzonitrile (631 mg, 3.22 mmol) in THF (5 mL) at −78° C. was added tert-butyl 1-piperazinecarboxylate (500 mg, 2.68 mmol) as a solid. The resultant mixture was heated to 100° C. and vigorously stirred overnight under nitrogen. The reaction was quenched with water and extracted with ethyl acetate. The combined organic layers were washed with brine, dried (MgSO4) and concentrated under reduced pressure. The residue was purified by flash chromatography (eluting with 0 to 30% ethyl acetate in hexane) to afford 4-(4-cyano-2-methyl-phenyl)-piperazine-1-carboxylic acid tert-butyl ester (702 mg, 86.9%). MS (ESI): 302.0 (M+H+).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08853243B2
Source datasetuspto-grants-2014_10
ORD IDord-3feaed3d8d6f4ae6b5d7028060ec2ef9
Source noteuspto-grants-2014_10