1,9-Dihydro-6H-Purin-6-One 7-Oxide
[CAS# 118974-81-5]

Identification

• Name: 1,9-Dihydro-6H-Purin-6-One 7-Oxide
• Synonyms: 6H-Purin-6-One, 1,9-Dihydro-, 7-Oxide; Hypoxanthine 7-N-Oxide; 1,9-Dihydro-6H-Purin-6-One 7-Oxide
• Molecular Formula: C₅H₄N₄O₂
• Molecular Weight: 152.11
• CAS Registry Number: 118974-81-5
• SMILES: C1=NC2=C([N]1O)C(=O)N=CN2
• InChI: 1S/C5H4N4O2/c10-5-3-4(6-1-7-5)8-2-9(3)11/h1-2,11H,(H,6,7,10)
• InChIKey: RBAILXDIIWBFAV-UHFFFAOYSA-N

Properties

• Density: 2.017g/cm³ (Cal.)
• Boiling point: 547.371°C at 760 mmHg (Cal.)
• Flash point: 284.84°C (Cal.)