5-Isocyanato-3-phenyl-1,2,4-oxadiazole
[CAS# 90484-03-0]

Identification

• Name: 5-Isocyanato-3-phenyl-1,2,4-oxadiazole
• Synonyms: 5-isocyanato-3-phenyl-1,2,4-oxadiazole
• Molecular Formula: C₉H₅N₃O₂
• Molecular Weight: 187.15
• CAS Registry Number: 90484-03-0
• SMILES: c1ccc(cc1)c2nc(on2)N=C=O
• InChI: 1S/C9H5N3O2/c13-6-10-9-11-8(12-14-9)7-4-2-1-3-5-7/h1-5H
• InChIKey: FMBXVKMVCXKNFW-UHFFFAOYSA-N

Properties

• Density: 1.353g/cm³ (Cal.)
• Boiling point: 329.486°C at 760 mmHg (Cal.)
• Flash point: 153.068°C (Cal.)