9-(3,4,5-Trihydroxyoxan-2-Yl)-3H-Purine-6-Thione
[CAS# 18520-89-3]

Identification

• Name: 9-(3,4,5-Trihydroxyoxan-2-Yl)-3H-Purine-6-Thione
• Synonyms: 9-(3,4,5-Trihydroxytetrahydropyran-2-Yl)-3H-Purine-6-Thione; 9-(3,4,5-Trihydroxy-2-Tetrahydropyranyl)-3H-Purine-6-Thione; Nsc107661
• Molecular Formula: C₁₀H₁₂N₄O₄S
• Molecular Weight: 284.29
• CAS Registry Number: 18520-89-3
• SMILES: C1=NC3=C([N]1C2C(C(C(CO2)O)O)O)NC=NC3=S
• InChI: 1S/C10H12N4O4S/c15-4-1-18-10(7(17)6(4)16)14-3-13-5-8(14)11-2-12-9(5)19/h2-4,6-7,10,15-17H,1H2,(H,11,12,19)
• InChIKey: BPIINOQXEGAJIX-UHFFFAOYSA-N

Properties

• Density: 2.03g/cm³ (Cal.)
• Boiling point: 677.516°C at 760 mmHg (Cal.)
• Flash point: 363.549°C (Cal.)