5-Phenyl-1,2,4-Oxadiazol-3(2H)-One
[CAS# 21084-84-4]

Identification

• Name: 5-Phenyl-1,2,4-Oxadiazol-3(2H)-One
• Synonyms: 1,2,4-Oxadiazol-3(2H)-One, 5-Phenyl-; 1,2,4-Oxadiazol-3-Ol, 5-Phenyl-
• Molecular Formula: C₈H₆N₂O₂
• Molecular Weight: 162.15
• CAS Registry Number: 21084-84-4
• SMILES: C1=CC(=CC=C1)C2=NC(NO2)=O
• InChI: 1S/C8H6N2O2/c11-8-9-7(12-10-8)6-4-2-1-3-5-6/h1-5H,(H,10,11)
• InChIKey: INVHTFJJZGBKTM-UHFFFAOYSA-N

Properties

• Density: 1.381g/cm³ (Cal.)
• Boiling point: 351.2°C at 760 mmHg (Cal.)
• Flash point: 166.2°C (Cal.)