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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 881968Generated: October 29, 2026

Water → N-Trifluoroacetyl-8-chloro-7-fluoro-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine

https://huagongshe.com/reaction/881968

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantTrifluoromethanesulfonic acidHCID 62406—
ReactantSelectfluorHCID 2724933—
ReactantN-trifluoroacetyl-8-chloro-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepineHCID 22292806—
Solvent1,2-DichloroethaneHCID 11—
ProductN-Trifluoroacetyl-8-chloro-7-fluoro-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepineHCID 2229279860.8%

Reaction Steps

A solution of N-trifluoroacetyl-8-chloro-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine (2.5 g, 8.5 mmol) in 1,2-dichloroethane (15 mL) was treated with Selectfluor (3.9 g, 11 mmol), trifluoromethanesulfonic acid (8 mL, 90 mmol) and stirred 60 hours at 75 C. The product mixture was poured into water (200 mL), extracted with EtOAc (200 mL), the organic phase washed with saturated aqueous NaHCO3 (2×100 mL), brine (100 mL), dried with Na2SO4 and concentrated. The crude product was purified by flash chromatography (6% EtOAc in hexane, silica) resulting in 1.6 g of a white solid. MS calculated for C13H12ClF4NO+H: 310, observed: 310.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08993750B2
Source datasetuspto-grants-2015_03
ORD IDord-f5a9fc520e694ce6bf511e06ac37a4c7
Source noteuspto-grants-2015_03