9-(3,4,5-Trihydroxyoxan-2-Yl)-3H-Purin-6-One
[CAS# 18520-88-2]

Identification

• Name: 9-(3,4,5-Trihydroxyoxan-2-Yl)-3H-Purin-6-One
• Synonyms: 9-(3,4,5-Trihydroxytetrahydropyran-2-Yl)-3H-Purin-6-One; 9-(3,4,5-Trihydroxy-2-Tetrahydropyranyl)-3H-Purin-6-One; Nsc110732
• Molecular Formula: C₁₀H₁₂N₄O₅
• Molecular Weight: 268.23
• CAS Registry Number: 18520-88-2
• SMILES: C1=NC3=C([N]1C2OCC(O)C(O)C2O)NC=NC3=O
• InChI: 1S/C10H12N4O5/c15-4-1-19-10(7(17)6(4)16)14-3-13-5-8(14)11-2-12-9(5)18/h2-4,6-7,10,15-17H,1H2,(H,11,12,18)
• InChIKey: UKUBRHKAZHFGHP-UHFFFAOYSA-N

Properties

• Density: 2.085g/cm³ (Cal.)
• Boiling point: 692.263°C at 760 mmHg (Cal.)
• Flash point: 372.467°C (Cal.)