4-(2-Methyl-2-Propanyl)-4H-1,2,4-Triazole
[CAS# 36175-37-8]

Identification

• Name: 4-(2-Methyl-2-Propanyl)-4H-1,2,4-Triazole
• Synonyms: 4-(tert-butyl)-4H-1,2,4-triazole
• Molecular Formula: C₆H₁₁N₃
• Molecular Weight: 125.17
• CAS Registry Number: 36175-37-8
• SMILES: n1ncn(c1)C(C)(C)C
• InChI: 1S/C6H11N3/c1-6(2,3)9-4-7-8-5-9/h4-5H,1-3H3
• InChIKey: BFNQTPVVSOLNOR-UHFFFAOYSA-N

Properties

• Density: 1.015g/cm³ (Cal.)
• Boiling point: 203.957°C at 760 mmHg (Cal.)
• Flash point: 77.151°C (Cal.)