4-(4H-1,2,4-Triazol-4-Yl)Butanenitrile
[CAS# 172839-73-5]

Identification

• Name: 4-(4H-1,2,4-Triazol-4-Yl)Butanenitrile
• Synonyms: 4-(4H-1,2,4-triazol-4-yl)butanenitrile; 4H-1,2,4-Triazole-4-butanenitrile
• Molecular Formula: C₆H₈N₄
• Molecular Weight: 136.15
• CAS Registry Number: 172839-73-5
• SMILES: c1nncn1CCCC#N
• InChI: 1S/C6H8N4/c7-3-1-2-4-10-5-8-9-6-10/h5-6H,1-2,4H2
• InChIKey: HTDXVNJBJUXUGC-UHFFFAOYSA-N

Properties

• Density: 1.159g/cm³ (Cal.)
• Boiling point: 342.451°C at 760 mmHg (Cal.)
• Flash point: 160.909°C (Cal.)
• Refractive index: 1.59 (Cal.)