2,1,3-Benzoxadiazole-5-carbonyl chloride 3-oxide
[CAS# 74221-41-3]

Identification

• Name: 2,1,3-Benzoxadiazole-5-carbonyl chloride 3-oxide
• Synonyms: 6-(chlorocarbonyl)benzo[c][1,2,5]oxadiazole 1-oxide
• Molecular Formula: C₇H₃ClN₂O₃
• Molecular Weight: 198.56
• CAS Registry Number: 74221-41-3
• SMILES: ClC(=O)c1ccc2no[n+]([O-])c2c1
• InChI: 1S/C7H3ClN2O3/c8-7(11)4-1-2-5-6(3-4)10(12)13-9-5/h1-3H
• InChIKey: LLWJWZNWYKPMNI-UHFFFAOYSA-N

Properties

• Density: 1.74g/cm³ (Cal.)
• Boiling point: 335.189°C at 760 mmHg (Cal.)
• Flash point: 156.517°C (Cal.)