[3-[(2-Amino-6-Oxo-3H-Purin-9-Yl)Methoxy]-4-Hydroxybutyl]Phosphonic Acid
[CAS# 104880-60-6]

Identification

• Name: [3-[(2-Amino-6-Oxo-3H-Purin-9-Yl)Methoxy]-4-Hydroxybutyl]Phosphonic Acid
• Synonyms: [3-[(2-Amino-6-Oxo-3H-Purin-9-Yl)Methoxy]-4-Hydroxy-Butyl]Phosphonic Acid; [3-[(2-Amino-6-Keto-3H-Purin-9-Yl)Methoxy]-4-Hydroxy-Butyl]Phosphonic Acid; Aids-186014
• Molecular Formula: C₁₀H₁₆N₅O₆P
• Molecular Weight: 333.24
• CAS Registry Number: 104880-60-6
• SMILES: C1=NC2=C([N]1COC(CC[P](O)(O)=O)CO)NC(=NC2=O)N
• InChI: 1S/C10H16N5O6P/c11-10-13-8-7(9(17)14-10)12-4-15(8)5-21-6(3-16)1-2-22(18,19)20/h4,6,16H,1-3,5H2,(H2,18,19,20)(H3,11,13,14,17)
• InChIKey: QVNXYSKNFUJRMI-UHFFFAOYSA-N

Properties

• Density: 1.941g/cm³ (Cal.)
• Boiling point: 794.589°C at 760 mmHg (Cal.)
• Flash point: 434.352°C (Cal.)