9-Oxa-1,3,5,8-tetraazatricyclo[6.1.1.0^2,7]deca-2,4,6-triene
[CAS# 727414-27-9]

Identification

• Name: 9-Oxa-1,3,5,8-tetraazatricyclo[6.1.1.0^2,7]deca-2,4,6-triene
• Synonyms: 1,3-METHANO[1,2,5]OXADIAZOLO[3,4-D]PYRIMIDINE(9CI); 8H-7,9-epoxypurine
• Molecular Formula: C₅H₄N₄O
• Molecular Weight: 136.11
• CAS Registry Number: 727414-27-9
• SMILES: c1c2c(ncn1)N3CN2O3
• InChI: 1S/C5H4N4O/c1-4-5(7-2-6-1)9-3-8(4)10-9/h1-2H,3H2
• InChIKey: WZAVJLAYNLEDNX-UHFFFAOYSA-N

Properties

• Density: 1.848g/cm³ (Cal.)
• Boiling point: 254.938°C at 760 mmHg (Cal.)
• Flash point: 107.983°C (Cal.)
• Refractive index: 1.832 (Cal.)