Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 20278Generated: October 25, 2026

4-Chlorophenyl isothiocyanate → tert-Butyl 4-{[(4-chlorophenyl)amino]carbonothioyl}-1,4-diazepane-1-carboxylate

https://huagongshe.com/reaction/20278

Reaction equation

Participants

RoleNameHCIDCharge
Reactant4-Chlorophenyl isothiocyanateHCID 16480—
ReactantTert-butyl 1,4-diazepane-1-carboxylateHCID 2756058—
SolventEthanolHCID 702—
Producttert-Butyl 4-{[(4-chlorophenyl)amino]carbonothioyl}-1,4-diazepane-1-carboxylateHCID 59347509—

Reaction Steps

A mixture of 4-chlorophenyl isothiocyanate (5.0 g, 29.95 mmol), and BOC-homopiperazine (6.0 g, 29.95 mmol) in ethanol (50 mL) was stirred at room temperature for 2 hours. The mixture was evaporated under reduced pressure, the residue was partitioned between ethyl acetate and water and the layers were separated. The organic phase was dried over MgSO4 and evaporated under reduced pressure to give the title compound as a white foam.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07745630B2
Source datasetuspto-grants-2010_06
ORD IDord-daa6eab60c9e4f4fa2b20aee2c27aaac
Source noteuspto-grants-2010_06