2,5-Diphenyl-1,2-Dihydro-3H-1,2,4-Triazol-3-One
[CAS# 118946-49-9]

Identification

• Name: 2,5-Diphenyl-1,2-Dihydro-3H-1,2,4-Triazol-3-One
• Synonyms: 1,2-Dihydro-2,5-(diphenyl)-3H-1,2,4-triazol-3-one; 2,5-diphenyl-1H-1,2,4-triazol-3-one
• Molecular Formula: C₁₄H₁₁N₃O
• Molecular Weight: 237.26
• CAS Registry Number: 118946-49-9
• SMILES: O=C2/N=C(\NN2c1ccccc1)c3ccccc3
• InChI: 1S/C14H11N3O/c18-14-15-13(11-7-3-1-4-8-11)16-17(14)12-9-5-2-6-10-12/h1-10H,(H,15,16,18)
• InChIKey: QULVOSFFSAYNEF-UHFFFAOYSA-N

Properties

• Density: 1.249g/cm³ (Cal.)
• Boiling point: 359.956°C at 760 mmHg (Cal.)
• Flash point: 171.495°C (Cal.)
• Refractive index: 1.662 (Cal.)