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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2044523Generated: November 1, 2026

Acetonitrile → HCID 58204296, compound

https://huagongshe.com/reaction/2044523

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetonitrileHCID 6342—
Reactant3-(Trifluoromethyl)phenylboronic acidHCID 2734388—
ReactantMethyl 2-iodo-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine-9-carboxylateHCID 58204516—
CatalystHCID 178418397HCID 178418397—
SolventSodium CarbonateHCID 10340—
ProductHCID 58204296HCID 5820429640.5%

Reaction Steps

Methyl 2-iodo-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepine-9-carboxylate (80 mg, 1 eq), 3-(trifluoromethyl)phenylboronic acid (76 mg, 1.75 eq), and tetrakis(triphenylphosphine)palladium (10 mg, 0.05 eq), in 1.0 M aqueous sodium carbonate (1.0 mL) and acetonitrile (1.0 mL) were heated to 140° C. for 10 min in a sealed microwave reactor. The crude reaction mixture was concentrated and purified using reverse phase HPLC to yield 299 (34 mg). ESI-MS: 389.1(M)+

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08586574B2
Source datasetuspto-grants-2013_11
ORD IDord-adb0613bb1f341ef9113bf457739a6aa
Source noteuspto-grants-2013_11