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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 450965Generated: October 27, 2026

m-Tolyl isocyanate → 6-Methyl-6-phenyl-3-m-tolyl-1,3-oxazinan-2-one

https://huagongshe.com/reaction/450965

Reaction equation

Participants

RoleNameHCIDCharge
Reactantm-Tolyl isocyanateHCID 69303—
Reactant1,8-Diazabicyclo(5.4.0)undec-7-eneHCID 81184—
Reactant3-Hydroxy-3-phenylbutyl 4-methylbenzenesulfonateHCID 53474285—
SolventDichloromethaneHCID 6344—
Product6-Methyl-6-phenyl-3-m-tolyl-1,3-oxazinan-2-oneHCID 25183314—

Reaction Steps

To a solution of 3-hydroxy-3-phenylbutyl 4-methylbenzenesulfonate (1 g, 3.12 mmol) and DBU (1.4 g, 9.26 mmol) in CH2Cl2 (15 mL) was added a solution of 3-methylphenyl isocyanate (623 mg, 4.68 mmol) in CH2Cl2 (5 mL) at 0° C. over 0.5 h. The mixture was stirred at rt overnight. The mixture was concentrated to give the crude product, which was purified by column chromatography and then by preparative HPLC to afford 6-methyl-6-phenyl-3-m-tolyl-1,3-oxazinan-2-one. LC-MS Method 2, tR=2.706 min, m/z=282. 1H NMR (CDCl3) 1.75 (s, 3H), 2.30 (s, 3H), 2.35-2.50 (m, 2H), 3.30 (m, 1H), 3.50 (m, 1H), 6.95 (m, 2H), 7.05 (m, 1H), 7.20-7.30 (m, 1H), 7.35 (m, 1H), 7.42-7.50 (m, 4H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08487094B2
Source datasetuspto-grants-2013_07
ORD IDord-b8556d8da30f4807b42123410d427eb0
Source noteuspto-grants-2013_07