78113-92-5

Basic information

• Product Name: N-butyl-6-phenyl-1,2,4,5-tetrazin-3-amine
• CAS NO: 78113-92-5
• Molecular Formula: C₁₂H₁₅N₅
• Molecular Weight: 229.281
• Mol File: 78113-92-5.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 405.2°C at 760 mmHg
• Flash Point: 198.9°C
• Density: 1.166g/cm³
• Vapor Pressure: 8.91E-07mmHg at 25°C
• Refractive Index: 1.594
• CAS DataBase Reference: N-butyl-6-phenyl-1,2,4,5-tetrazin-3-amine(CAS DataBase Reference)
• NIST Chemistry Reference: N-butyl-6-phenyl-1,2,4,5-tetrazin-3-amine(78113-92-5)
• EPA Substance Registry System: N-butyl-6-phenyl-1,2,4,5-tetrazin-3-amine(78113-92-5)

Safety Data

• Hazardous Substances Data: 78113-92-5(Hazardous Substances Data)

Upstream product

• 36022-11-4 3-phenyl-[1,2,4,5]tetrazine 
• 109-73-9 N-butylamine 
• 98-80-6 phenylboronic acid 

Relevant articles and documents

Preparation of Unsymmetrical 1,2,4,5-Tetrazines via a Mild Suzuki Cross-Coupling Reaction

N-Alkyl substituted chlorotetrazines were coupled with various boronic acids under Suzuki conditions in high yield at room temperature, giving a mild and straightforward synthetic route toward diverse unsymmetrical 1,2,4,5-tetrazines, a rare heteroarene. This chemistry not only expands the known substrate scope of tetrazine cross-coupling reactions but also allows for the synthesis of novel, tetrazine-containing biologically active molecules with improved DMPK properties.