5,6-Dimethyl-1-Oxido-2,1,3-Benzoxadiazol-1-Ium
[CAS# 39132-77-9]

Identification

• Name: 5,6-Dimethyl-1-Oxido-2,1,3-Benzoxadiazol-1-Ium
• Synonyms: 5,6-Dimethyl-1-Oxido-Benzofurazan-1-Ium; Nsc172605
• Molecular Formula: C₈H₈N₂O₂
• Molecular Weight: 164.16
• CAS Registry Number: 39132-77-9
• SMILES: C1=C(C(=CC2=NO[N+](=C12)[O-])C)C
• InChI: 1S/C8H8N2O2/c1-5-3-7-8(4-6(5)2)10(11)12-9-7/h3-4H,1-2H3
• InChIKey: YNVKVZHZPNWXSW-UHFFFAOYSA-N

Properties

• Density: 1.348g/cm³ (Cal.)
• Boiling point: 286.591°C at 760 mmHg (Cal.)
• Flash point: 127.126°C (Cal.)