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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1094608Generated: October 30, 2026

Water → HCID 57559122, compound

https://huagongshe.com/reaction/1094608

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantTert-Butyl hypochloriteHCID 521297—
ReactantHCID 57559106HCID 57559106—
SolventDichloromethaneHCID 6344—
ProductHCID 57559122HCID 57559122—

Reaction Conditions

Temperature0 °C

Reaction Steps

To a solution of N-methyl 3-(4-fluorobenzoyl)-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole-5-carbamide and TEA in DCM at 0° C. was added a cooled (0° C.) solution of tert-butyl hypochloride (57 mL, 0.5 mmol) in DCM. The reaction mixture was stirred for 1.5 hours at 0° C. Cold water was added to wash the solution. Organic layer was separated and the aqueous layer was extracted with DCM. The combined organic layers were washed by water and dried over MgSO4. Evaporation of solvent gave a crude product, which was purified by chromatography on silica gel eluting with MeOH-DCM to give the title compound (14 mg); 1H-NMR (CDCl3): δ 10.04 (1H, br s), 7.57 (2H, m), 7.52 (1H, d), 7.37 (1H, d), 7.24 (1H, m), 7.12 (4H, m) 5.9 (1H, br s), 4.15 (2H, t), 3.27 (2H, t), 2.92 (3H, d); MS (ES): 378 (MH+).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08133992B2
Source datasetuspto-grants-2012_03
ORD IDord-77e1ffe10f2441a49ffc3c6e4b6fdf91
Source noteuspto-grants-2012_03