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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 436820Generated: October 31, 2026

Methyl Isocyanate → N-[3-(1,1-Dimethylethyl)-5-isoxazolyl]-N,N′-dimethylurea

https://huagongshe.com/reaction/436820

Reaction equation

Participants

RoleNameHCIDCharge
ReactantMethyl IsocyanateHCID 12228—
ReactantHCID 13292903HCID 13292903—
ProductN-[3-(1,1-Dimethylethyl)-5-isoxazolyl]-N,N′-dimethylureaHCID 1329290486.5%

Reaction Conditions

Temperature80 °C

Reaction Steps

A mixture of 3-t-butyl-5-methylaminoisoxazole (2.16 g) and methyl isocyanate (1.04 g) is heated at 80° C. in a sealed tube for 13 hours. Then, methyl isocyanate (0.40 g) is added thereto, and the resultant mixture is heated at 80° C. for 9 hours. The reaction mixture is chromatographed on a column of silica gel, whereby 1,3-dimethyl-3-(3-t-butyl-5-isoxazolyl)-urea (2.56 g) is obtained. The yield is 86.3%. IR: 1700, 1598 cm-1 (CC14).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS04028376
Source datasetuspto-grants-1977_06
ORD IDord-fc3631dd6ec44381ac71459060b4fc8e
Source noteuspto-grants-1977_06