3-(o-Tolyl)-5-(alpha,alpha,alpha-Trifluoro-m-Tolyl)-1H-1,2,4-Triazole
[CAS# 69095-77-8]

Identification

• Name: 3-(o-Tolyl)-5-(alpha,alpha,alpha-Trifluoro-m-Tolyl)-1H-1,2,4-Triazole
• Synonyms: 1H-1,2,4-Triazole, 3-(2-Methylphenyl)-5-(3-(Trifluoromethyl)Phenyl)-; 3-(O-Tolyl)-5-(Alpha,Alpha,Alpha-Trifluoro-M-Tolyl)-S-Triazole; Brn 5593829
• Molecular Formula: C₁₆H₁₂F₃N₃
• Molecular Weight: 303.29
• CAS Registry Number: 69095-77-8
• SMILES: C1=CC=CC(=C1C)C2=NC(=N[NH]2)C3=CC(=CC=C3)C(F)(F)F
• InChI: 1S/C16H12F3N3/c1-10-5-2-3-8-13(10)15-20-14(21-22-15)11-6-4-7-12(9-11)16(17,18)19/h2-9H,1H3,(H,20,21,22)
• InChIKey: DYGMEXLJCFIJME-UHFFFAOYSA-N

Properties

• Density: 1.293g/cm³ (Cal.)
• Boiling point: 453.061°C at 760 mmHg (Cal.)
• Flash point: 227.803°C (Cal.)