3-(O-Cumenyl)-5-Phenyl-1H-1,2,4-Triazole
[CAS# 69095-86-9]

Identification

• Name: 3-(O-Cumenyl)-5-Phenyl-1H-1,2,4-Triazole
• Synonyms: 3-(2-Isopropylphenyl)-5-Phenyl-2H-1,2,4-Triazole; 1H-1,2,4-Triazole, 3-(2-(1-Methylethyl)Phenyl)-5-Phenyl-; 1H-1,2,4-Triazole, 3-(O-Isopropylphenyl)-5-Phenyl-
• Molecular Formula: C₁₇H₁₇N₃
• Molecular Weight: 263.34
• CAS Registry Number: 69095-86-9
• SMILES: C1=CC=CC(=C1C(C)C)C2=NC(=N[NH]2)C3=CC=CC=C3
• InChI: 1S/C17H17N3/c1-12(2)14-10-6-7-11-15(14)17-18-16(19-20-17)13-8-4-3-5-9-13/h3-12H,1-2H3,(H,18,19,20)
• InChIKey: UZYSRLVDUAGZEI-UHFFFAOYSA-N

Properties

• Density: 1.121g/cm³ (Cal.)
• Boiling point: 459.788°C at 760 mmHg (Cal.)
• Flash point: 207.352°C (Cal.)