9-(6'-Deoxy-beta-D-Allofuranosyl)Hypoxanthine
[CAS# 85421-86-9]

Identification

• Name: 9-(6'-Deoxy-beta-D-Allofuranosyl)Hypoxanthine
• Synonyms: 9-[3,4-Dihydroxy-5-(1-Hydroxyethyl)Tetrahydrofuran-2-Yl]-3H-Purin-6-One; 9-[3,4-Dihydroxy-5-(1-Hydroxyethyl)-2-Tetrahydrofuranyl]-3H-Purin-6-One; Nsc347786
• Molecular Formula: C₁₁H₁₄N₄O₅
• Molecular Weight: 282.26
• CAS Registry Number: 85421-86-9
• SMILES: C1=NC3=C([N]1C2OC(C(O)C2O)C(O)C)NC=NC3=O
• InChI: 1S/C11H14N4O5/c1-4(16)8-6(17)7(18)11(20-8)15-3-14-5-9(15)12-2-13-10(5)19/h2-4,6-8,11,16-18H,1H3,(H,12,13,19)
• InChIKey: GNEUXCLUOVTONK-UHFFFAOYSA-N

Properties

• Density: 1.962g/cm³ (Cal.)
• Boiling point: 702.279°C at 760 mmHg (Cal.)
• Flash point: 378.525°C (Cal.)