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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1295728Generated: October 31, 2026

Water → HCID 69367896, compound

https://huagongshe.com/reaction/1295728

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantPotassium tert-butoxideHCID 23665647—
Reactant1,1-Dimethylethyl 4-(3-chloro-2-pyrazinyl)hexahydro-1H-1,4-diazepine-1-carboxylateHCID 86591625—
SolventEthylene GlycolHCID 174—
Solvent1,4-DioxaneHCID 31275—
ProductHCID 69367896HCID 69367896—

Reaction Conditions

Temperature90 °C

Reaction Steps

To a stirred mixture of tert-butyl 4-(3-chloropyrazin-2-yl)-1,4-diazepane-1-carboxylate (2.5 g, 8.0 mmol; from Step 1) in ethylene glycol (8 mL) and dioxane (25 mL), was added t-BuOK (0.99 g, 8.8 mmol). The mixture was heated at 90° C. with condenser, under N2, overnight. Water (10 mL) was added to the light brown mixture and extracted with dichloromethane (3×20 mL). The organic phase was dried over MgSO4. The solution was filtered and the solvent evaporated. The residue was purified by chromatography on silica gel using toluene/EtOAc (2:3) as eluent. 1H NMR analysis supports the stated structure. Yield: 1.66 g (61%). HPLC purity: 100%. MS m/z 339 (M+H)+.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07244722B2
Source datasetuspto-grants-2007_07
ORD IDord-19d13c59aca0420ba63df62621e578ca
Source noteuspto-grants-2007_07