5,7-Dinitro-1,2,3-benzoxadiazole
[CAS# 87-31-0]

Identification

• Classification: Pharmaceutical intermediate >> Heterocyclic compound intermediate >> Pyrimidine compound >> Amine
• Name: 5,7-Dinitro-1,2,3-benzoxadiazole
• Synonyms: 1,2,3-Benzoxadiazole, 5,7-Dinitro-; Diazodinitrophenol, Wetted With Not <40% Water Or Mixture Of Alcohol And Water, By Mass [Un0074] [ Explosive 1.1A]; Un0074
• Molecular Formula: C₆H₂N₄O₅
• Molecular Weight: 210.11
• CAS Registry Number: 87-31-0
• SMILES: C1=C(C2=C(C=C1[N+](=O)[O-])N=NO2)[N+](=O)[O-]
• InChI: 1S/C6H2N4O5/c11-9(12)3-1-4-6(15-8-7-4)5(2-3)10(13)14/h1-2H
• InChIKey: IFYCOVMLDMKOHK-UHFFFAOYSA-N

Properties

• Density: 1.804g/cm³ (Cal.)
• Boiling point: 377.922°C at 760 mmHg (Cal.)
• Flash point: 182.361°C (Cal.)