2-(6-Aminopurin-9-Yl)-6-(Hydroxymethyl)Oxane-3,4,5-Triol
[CAS# 37515-26-7]

Identification

• Name: 2-(6-Aminopurin-9-Yl)-6-(Hydroxymethyl)Oxane-3,4,5-Triol
• Synonyms: 2-(6-Aminopurin-9-Yl)-6-(Hydroxymethyl)Tetrahydropyran-3,4,5-Triol; 2-(6-Amino-9-Purinyl)-6-(Hydroxymethyl)Tetrahydropyran-3,4,5-Triol; 2-(6-Aminopurin-9-Yl)-6-Methylol-Tetrahydropyran-3,4,5-Triol
• Molecular Formula: C₁₁H₁₅N₅O₅
• Molecular Weight: 297.27
• CAS Registry Number: 37515-26-7
• SMILES: C1=NC3=C([N]1C2OC(C(O)C(O)C2O)CO)N=CN=C3N
• InChI: 1S/C11H15N5O5/c12-9-5-10(14-2-13-9)16(3-15-5)11-8(20)7(19)6(18)4(1-17)21-11/h2-4,6-8,11,17-20H,1H2,(H2,12,13,14)
• InChIKey: PAECLWKKOWTEJJ-UHFFFAOYSA-N

Properties

• Density: 2.1g/cm³ (Cal.)
• Boiling point: 694.19°C at 760 mmHg (Cal.)
• Flash point: 373.633°C (Cal.)