9-(6'-Deoxy-beta-D-Allofuranosyl)Guanine
[CAS# 85421-89-2]

Identification

• Name: 9-(6'-Deoxy-beta-D-Allofuranosyl)Guanine
• Synonyms: 2-Amino-9-[3,4-Dihydroxy-5-(1-Hydroxyethyl)Tetrahydrofuran-2-Yl]-3H-Purin-6-One; 2-Amino-9-[3,4-Dihydroxy-5-(1-Hydroxyethyl)-2-Tetrahydrofuranyl]-3H-Purin-6-One; Nsc347203
• Molecular Formula: C₁₁H₁₅N₅O₅
• Molecular Weight: 297.27
• CAS Registry Number: 85421-89-2
• SMILES: C1=NC3=C([N]1C2OC(C(O)C2O)C(O)C)NC(=NC3=O)N
• InChI: 1S/C11H15N5O5/c1-3(17)7-5(18)6(19)10(21-7)16-2-13-4-8(16)14-11(12)15-9(4)20/h2-3,5-7,10,17-19H,1H3,(H3,12,14,15,20)
• InChIKey: PYNVSZMFFVWFQA-UHFFFAOYSA-N

Properties

• Density: 2.113g/cm³ (Cal.)
• Boiling point: 744.269°C at 760 mmHg (Cal.)
• Flash point: 403.92°C (Cal.)