9-(5-O-Phosphono-beta-D-Ribofuranosyl)-9H-Purine
[CAS# 13484-60-1]

Identification

• Name: 9-(5-O-Phosphono-beta-D-Ribofuranosyl)-9H-Purine
• Synonyms: (3,4-Dihydroxy-5-Purin-9-Yl-Tetrahydrofuran-2-Yl)Methyl Dihydrogen Phosphate; [3,4-Dihydroxy-5-(9-Purinyl)-2-Tetrahydrofuranyl]Methyl Dihydrogen Phosphate; (3,4-Dihydroxy-5-Purin-9-Yl-Oxolan-2-Yl)Methyl Dihydrogen Phosphate
• Molecular Formula: C₁₀H₁₃N₄O₇P
• Molecular Weight: 332.21
• CAS Registry Number: 13484-60-1
• SMILES: C1=NC3=C([N]1C2OC(C(O)C2O)CO[P](=O)(O)O)N=CN=C3
• InChI: 1S/C10H13N4O7P/c15-7-6(2-20-22(17,18)19)21-10(8(7)16)14-4-13-5-1-11-3-12-9(5)14/h1,3-4,6-8,10,15-16H,2H2,(H2,17,18,19)
• InChIKey: MCWDCZIDTUQRHK-UHFFFAOYSA-N

Properties

• Density: 2.173g/cm³ (Cal.)
• Boiling point: 720.855°C at 760 mmHg (Cal.)
• Flash point: 389.759°C (Cal.)