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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 885012Generated: October 30, 2026

Ethyl Acetate → HCID 59594390, compound

https://huagongshe.com/reaction/885012

Reaction equation

Participants

RoleNameHCIDCharge
ReactantEthyl AcetateHCID 8857—
ReactantAluminum(III) ChlorideHCID 6451240—
ReactantHCID 59594394HCID 59594394—
SolventAnisoleHCID 7519—
ProductHCID 59594390HCID 5959439099.1%

Reaction Conditions

Temperature85 °C

Reaction Steps

(Z)-7-Chloro-3-(2-chlorobenzyl)-5-(4-methoxyphenyl)-1-(4-methoxybenzyl)-1H-benzo[e][1,4]diazepin-2(3H)-one (128 mg, 0.235 mmol) was dissolved in anisole (1 mL) under nitrogen and AlCl3 (125 mg, 0.939 mmol) was added in one portion. The resulting orange solution was heated to 85° C. for 2 h. After the mixture was cooled to room temperature, ice and ethyl acetate were added and the mixture was stirred for 30 min. The layers were partitioned and the organic layer was washed with water then brine. The combined aqueous layers were back-extracted with ethyl acetate and the combined organic layers were dried (MgSO4), filtered and evaporated. The residue was chromatographed on silica gel, eluting with 5%, then 30% ethyl acetate in hexanes to give (Z)-7-chloro-3-(2-chlorobenzyl)-5-(4-methoxyphenyl)-1H-benzo[e][1,4]diazepin-2(3H)-one as a white solid (99 mg, 99%). 1H NMR (300 MHz, CDCl3) δ 3.60-3.77 (m, 2H), 3.84 (s, 3H), 3.84-3.86 (m, 1H), 6.88 (dd, J=7, 2 Hz, 2H), 7.08 (d, J=9 Hz, 1H), 7.15-7.33 (m, 3H), 7.38 (dd, J=7, 2 Hz, 2H), 7.45 (dd, J=9, 2 Hz, 1H), 7.60 (dd, J=8, 2 Hz, 1H), 8.59 (s, 1H); ESI m/z 425.1.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08242109B2
Source datasetuspto-grants-2012_08
ORD IDord-bf5d4e82282249e894c309c602efad40
Source noteuspto-grants-2012_08