4-Phenyl-2H-1,2,4-Triazol-3-One
[CAS# 1008-30-6]

Identification

• Name: 4-Phenyl-2H-1,2,4-Triazol-3-One
• Synonyms: 4-Phenyl-2,4-Dihydro-3H-1,2,4-Triazol-3-One; Mls000736464; Smr000338414
• Molecular Formula: C₈H₇N₃O
• Molecular Weight: 161.16
• CAS Registry Number: 1008-30-6
• SMILES: C1=CC=CC=C1N2C(NN=C2)=O
• InChI: 1S/C8H7N3O/c12-8-10-9-6-11(8)7-4-2-1-3-5-7/h1-6H,(H,10,12)
• InChIKey: UYVVGXZLFHZTKT-UHFFFAOYSA-N

Properties

• Density: 1.324g/cm³ (Cal.)
• Melting point: 184-186°C (Expl.)