95309-35-6

Basic information

• Product Name: 1-isopropyl-3,5-diphenyl-1H-1,2,4-triazole
• Synonyms: 1-isopropyl-3,5-diphenyl-1H-1,2,4-triazole
• CAS NO: 95309-35-6
• Molecular Weight: 263.342
• Mol File: 95309-35-6.mol

Chemical Properties

• CAS DataBase Reference: 1-isopropyl-3,5-diphenyl-1H-1,2,4-triazole(CAS DataBase Reference)
• NIST Chemistry Reference: 1-isopropyl-3,5-diphenyl-1H-1,2,4-triazole(95309-35-6)
• EPA Substance Registry System: 1-isopropyl-3,5-diphenyl-1H-1,2,4-triazole(95309-35-6)

Safety Data

• Hazardous Substances Data: 95309-35-6(Hazardous Substances Data)

Upstream product

• 95309-30-1 1,4-dihydro-1-isopropyl-3,6-diphenyl-s-tetrazine 
• 14478-73-0 3,6-diphenyl-1,4-dihydro-1,2,4,5-tetrazine 
• 70629-60-6 isopropylhydrazine hydrochloride 
• 100-47-0 benzonitrile 
• 95309-27-6 1,4-dihydro-1-(4-methylphenyl)-3,6-diphenyl-s-tetrazine 
• 6830-78-0 3,6-diphenyl-1,2,4,5-tetrazine 

Relevant articles and documents

A practical base mediated synthesis of 1,2,4-triazoles enabled by a deamination annulation strategy

A rapid and efficient base mediated synthesis of 1,3,5-trisubstituted 1,2,4-triazoles has been developed using the annulation of nitriles with hydrazines, which can be expanded to a wide range of triazoles in good to excellent yields. Ammonia gas is liberated during the reaction, and halo and hetero functional groups as well as free hydroxyl and amino groups are tolerated in this transformation. A variety of alkyl and aryl-substituted nitriles can be functionalized with aromatic and aliphatic hydrazines employing this procedure. This finding provides a practical and useful strategy for the synthesis of various 15N-labeled 1,2,4-triazole derivatives, and two types of mGlu5 receptor pharmaceuticals can be easily assembled in a one-pot manner. This journal is

Rearrangement Reactions of 1,3,6-Triaryl-1,4-dihydro-s-tetrazines leading to 2,4-Diarylquinazolines, 1-Anilino-3,5-diaryl-1H-1,2,4-triazoles, 1,3,5-Triaryl-1H-1,2,4-triazoles, and 2,5-Diaryl-1H-1,3,4-oxadiazoles. X-ray Structure Determination of 6-Isopropyl-2,4-diphenylquinazoline

1,3,6-Triaryl-1,4-dihydro-s-tetrazines (2c-g) rearrange on heating at ca. 200 deg C to 2,4-diarylquinazolines (for which an X-ray determination was carried out on the 6-isopropyl compound) and 1-anilino-3,5-diaryl-1H-1,2,4-triazoles as major products.Hydrolysis in chloroform solution of the title compounds (2) and their 1-alkyl analogues gives rise to 1-aryl (or alkyl)-3,5-diaryl-1H-1,2,4-triazoles and 2,5-diaryl-1,3,4-oxadiazoles.

Thermal Rearrrangement of 1-Alkyl-3,6-diaryl-1,4-dihydro-s-tetrazines to 1-Alkylamino-3,5-diaryl-1,2,4-triazoles

s-Tetrazines having aryl substituents in either the 3- or 3,6-positions react readily with alkyl or aryl Grignard reagents to give 1-alkyl(or aryl)-1,4-dihydro-s-terazines.The 1-alkyl-1,4-dihydro-s-tetrazines rearrange in methanolic hydrogen chloride to 4-alkylamino-1,2,4-triazoles, but thermolyse readily to the less well known, isomeric 1-alkylamino-1,2,4-triazoles.Possible reaction pathways involving breakdown to nitrile and reactive intermediates such as 1,3-dipolar species are discussed.