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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1380176Generated: October 31, 2026

Butyl isocyanate → 1-{3-[4-(4-Chlorobenzyl)piperazin-1-yl]propyl}-3-n-butylurea dihydrochloride hemihydrate

https://huagongshe.com/reaction/1380176

Reaction equation

Participants

RoleNameHCIDCharge
ReactantButyl isocyanateHCID 8110—
ReactantHCID 13606667HCID 13606667—
SolventDichloromethaneHCID 6344—
Product1-{3-[4-(4-Chlorobenzyl)piperazin-1-yl]propyl}-3-n-butylurea dihydrochloride hemihydrateHCID 131714595213.9%

Reaction Steps

A solution of 1-(3-aminopropyl)-4-(4-chlorobenzyl)piperazine (2.67 g; 10 mmole) in methylene chloride (50 ml) was refluxed for two hours with n-butyl isocyanate (1.09 g; 11 mmole). The reaction mixture was concentrated in vacuo, and the residue was treated with ethereal hydrogen chloride. Recrystallization of the precipitate from methylene chloride/methanol provided with title compound as colorless crystals (3.2 g; 71% yield), m.p. 222°-223° C.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS04579947
Source datasetuspto-grants-1986_04
ORD IDord-b976ba6b379749e594794e7b30df558d
Source noteuspto-grants-1986_04