3-(o-Tolyl)-5-(p-Tolyl)-1H-1,2,4-Triazole
[CAS# 65697-89-4]

Identification

• Name: 3-(o-Tolyl)-5-(p-Tolyl)-1H-1,2,4-Triazole
• Synonyms: S-Triazole, 3-(O-Tolyl)-5-(P-Tolyl)-; 1H-1,2,4-Triazole, 3-(2-Methylphenyl)-5-(4-Methylphenyl)-; 3-(O-Tolyl)-5-(P-Tolyl)-S-Triazole
• Molecular Formula: C₁₆H₁₅N₃
• Molecular Weight: 249.31
• CAS Registry Number: 65697-89-4
• SMILES: C1=C(C(=CC=C1)C2=NC(=N[NH]2)C3=CC=C(C=C3)C)C
• InChI: 1S/C16H15N3/c1-11-7-9-13(10-8-11)15-17-16(19-18-15)14-6-4-3-5-12(14)2/h3-10H,1-2H3,(H,17,18,19)
• InChIKey: QHLGMHWLIPIGPX-UHFFFAOYSA-N

Properties

• Density: 1.147g/cm³ (Cal.)
• Boiling point: 458.787°C at 760 mmHg (Cal.)
• Flash point: 210.184°C (Cal.)