Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1986845Generated: October 31, 2026

Imidazole → (S)-4-(3-Iodo-2-methylpropyl]-4H-benzo[1,4]oxazin-3-one

https://huagongshe.com/reaction/1986845

Reaction equation

Participants

RoleNameHCIDCharge
ReactantImidazoleHCID 795—
ReactantIodineHCID 807—
ReactantTriphenylphosphineHCID 11776—
Reactant(S)-4-(3-Hydroxy-2-methylpropyl]-4H-benzo[1,4]oxazin-3-oneHCID 68915929—
SolventChloroformHCID 6212—
Product(S)-4-(3-Iodo-2-methylpropyl]-4H-benzo[1,4]oxazin-3-oneHCID 6891222480%

Reaction Steps

A reaction flask was charged with (S)-4-(3-Hydroxy-2-methylpropyl]-4H-benzo[1,4]oxazin-3-one (2.52 g, 11.4 mmol), triphenylphosphine (6.12 g, 23.3 mmol), imidazole (1.98 g, 29.1 mmol), and iodine (8.88 g, 35.0 mmol) in CHCl3 (30 mL) and stirred at rt for 20 h. The reaction mixture was washed with saturated sodium thiosulfate, dried over Na2SO4, filtered, and concentrated. The product was purified by flash column chromatography (SiO2; n-heptane/EtOAc 3:1) to give the title compound (3.02 g, 80%). 1H NMR (CDCl3) δ 7.07-7.00 (m, 4H), 4.65-4.55 (m, 2H), 3.94 (dd, J=1.7 Hz, J=6.7 Hz, CH2), 3.23-3.14 (m, 2H), 2.18-2.07 (m, 1H), 1.05 (d, J=6.1 Hz, CH3).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07550459B2
Source datasetuspto-grants-2009_06
ORD IDord-9faa44b9c1204c828cf3411f39b937af
Source noteuspto-grants-2009_06