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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2267630Generated: November 1, 2026

Trifluoroacetic acid → HCID 86604636, compound

https://huagongshe.com/reaction/2267630

Reaction equation

Participants

RoleNameHCIDCharge
ReactantTrifluoroacetic acidHCID 6422—
ReactantHCID 86604637HCID 86604637—
SolventDichloromethaneHCID 6344—
ProductHCID 86604636HCID 8660463699%

Reaction Steps

tert-Butyl [(2R,3S)-4-oxo-2-phenyl-5-prop-2-yn-1-yl-2,3,4,5-tetrahydro-1,5-benzoxazepin-3-yl]carbamate (67b) (125 mg, 0.318 mmol) was dissolved in 5:1 (v/v) dichloromethane:trifluoroacetic acid (4 mL) and kept at ambient temperature for 90 min. The solution was evaporated and the residue was dissolved in ethyl acetate and extracted with saturated aqueous sodium bicarbonate. The organic solution was dried and evaporated to afford the title compound (92 mg, 99%) as a white solid. 1H NMR (300 MHz, CDCl3) δ1.36 (br s, 2H), 2.29 (t, 1H, J=2.3 Hz), 4.10 (m, 1H), 4.56 and 4.61 (dd, 1H, J=2.4 Hz), 4.76 and 4.81 (dd, 1H, J=2.4 Hz), 5.46 (d, 1H, J=7.4 Hz), 7.27 (m, 3H), 7.38 (m, 3H), 7.47 (m, 3H). MS APCI, m/z=293 (M+1). LC/MS: 1.63 min.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07858776B2
Source datasetuspto-grants-2010_12
ORD IDord-27c6b77542974914a0fae42c11ef92e6
Source noteuspto-grants-2010_12