3-(4-Methylphenyl)-5-Phenyl-2H-1,2,4-Triazole
[CAS# 3213-95-4]

Identification

• Name: 3-(4-Methylphenyl)-5-Phenyl-2H-1,2,4-Triazole
• Synonyms: 3-(4-Methylphenyl)-5-Phenyl-1H-1,2,4-Triazole; 3-Phenyl-5-P-Tolyl-S-Triazole; S-Triazole, 3-Phenyl-5-P-Tolyl-
• Molecular Formula: C₁₅H₁₃N₃
• Molecular Weight: 235.29
• CAS Registry Number: 3213-95-4
• SMILES: C1=CC(=CC=C1C2=NC(=N[NH]2)C3=CC=CC=C3)C
• InChI: 1S/C15H13N3/c1-11-7-9-13(10-8-11)15-16-14(17-18-15)12-5-3-2-4-6-12/h2-10H,1H3,(H,16,17,18)
• InChIKey: OGSBRDJAMKKTRH-UHFFFAOYSA-N

Properties

• Density: 1.17g/cm³ (Cal.)
• Boiling point: 446.08°C at 760 mmHg (Cal.)
• Flash point: 206.556°C (Cal.)