85694-39-9

Basic information

• Product Name: 1,2,4-Triazolidine-3,5-dione, 1-(1-methyl-5-nitro-1H-imidazol-2-yl)-4-(2-phenylethyl)-
• CAS NO: 85694-39-9
• Molecular Formula: C14H14N6O4
• Molecular Weight: 330.303
• Mol File: 85694-39-9.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: 1,2,4-Triazolidine-3,5-dione, 1-(1-methyl-5-nitro-1H-imidazol-2-yl)-4-(2-phenylethyl)-(CAS DataBase Reference)
• NIST Chemistry Reference: 1,2,4-Triazolidine-3,5-dione, 1-(1-methyl-5-nitro-1H-imidazol-2-yl)-4-(2-phenylethyl)-(85694-39-9)
• EPA Substance Registry System: 1,2,4-Triazolidine-3,5-dione, 1-(1-methyl-5-nitro-1H-imidazol-2-yl)-4-(2-phenylethyl)-(85694-39-9)

Safety Data

• Hazardous Substances Data: 85694-39-9(Hazardous Substances Data)

Upstream product

• 85694-45-7 4-Phenethyl-1,2,4-triazolidine-3,5-dione 
• 1615-53-8 1-methyl-2-methylsulphonyl-5-nitro-imidazole 

Relevant articles and documents

Nitroimidazoles: Part V - 1-(1-Methyl-5-nitroimidazol-2-yl)-1,2,4-triazolidin-3,5-diones and Analogues

Condensation of 1-methyl-2-methylsulphonyl-5-nitroimidazole (1) with the sodium salts of triazolindiones affords the derivatives 2a-i; similiar reaction with the sodium salts of thiazolidinone, 2-iminothiazolidine, pyrrolidinone, oxazolidinone and its 2-methyl and 2-chloromethyl analogues leads to the formation of products 3-8 respectively.Under the reaction conditions 3 is opened by dimethylamide ion to form 10, and 6 by methyl sulfinate ion to provide 13 respectively.Additionally, 6 is hydrolysed to the amine (12).Cyclic sulphamides undergo reaction with 1 to provide nitroimidazoles (23-28).