[(2S,5S)-5-(4-Amino-2-Oxopyrimidin-1-Yl)Oxolan-2-Yl]Methyl Phosphono Hydrogen Phosphate
[CAS# 104086-75-1]

Identification

• Name: [(2S,5S)-5-(4-Amino-2-Oxopyrimidin-1-Yl)Oxolan-2-Yl]Methyl Phosphono Hydrogen Phosphate
• Synonyms: [(2S,5S)-5-(4-Amino-2-Oxo-Pyrimidin-1-Yl)Tetrahydrofuran-2-Yl]Methyl Phosphono Hydrogen Phosphate; [(2S,5S)-5-(4-Amino-2-Oxo-1-Pyrimidinyl)-2-Tetrahydrofuranyl]Methyl Phosphono Hydrogen Phosphate; [(2S,5S)-5-(4-Amino-2-Keto-Pyrimidin-1-Yl)Tetrahydrofuran-2-Yl]Methyl Phosphono Hydrogen Phosphate
• Molecular Formula: C₉H₁₅N₃O₉P₂
• Molecular Weight: 371.18
• CAS Registry Number: 104086-75-1
• SMILES: [C@@H]1(O[C@@H](CC1)CO[P](O[P](=O)(O)O)(=O)O)N2C(=O)N=C(N)C=C2
• InChI: 1S/C9H15N3O9P2/c10-7-3-4-12(9(13)11-7)8-2-1-6(20-8)5-19-23(17,18)21-22(14,15)16/h3-4,6,8H,1-2,5H2,(H,17,18)(H2,10,11,13)(H2,14,15,16)/t6-,8-/m0/s1
• InChIKey: FVSQWXITYSICAK-XPUUQOCRSA-N

Properties

• Density: 2.099g/cm³ (Cal.)
• Boiling point: 654.589°C at 760 mmHg (Cal.)
• Flash point: 349.683°C (Cal.)