3-[(2S,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)Oxolan-2-Yl]-4,6-Dimethylimidazo[1,2-a]Purin-9-One
[CAS# 129266-21-3]

Identification

• Name: 3-[(2S,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)Oxolan-2-Yl]-4,6-Dimethylimidazo[1,2-a]Purin-9-One
• Synonyms: 3-[(2S,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-4,6-Dimethyl-Imidazo[1,2-A]Purin-9-One; 3-[(2S,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]-4,6-Dimethyl-9-Imidazo[1,2-A]Purinone; 3-[(2S,4S,5R)-4-Hydroxy-5-Methylol-Tetrahydrofuran-2-Yl]-4,6-Dimethyl-Imidazo[1,2-A]Purin-9-One
• Molecular Formula: C₁₄H₁₇N₅O₄
• Molecular Weight: 319.32
• CAS Registry Number: 129266-21-3
• SMILES: [C@H]4([N]1C=NC3=C1N(C2=NC(=C[N]2C3=O)C)C)O[C@@H]([C@@H](O)C4)CO
• InChI: 1S/C14H17N5O4/c1-7-4-18-13(22)11-12(17(2)14(18)16-7)19(6-15-11)10-3-8(21)9(5-20)23-10/h4,6,8-10,20-21H,3,5H2,1-2H3/t8-,9+,10-/m0/s1
• InChIKey: IPHXYLSCKSTFDP-AEJSXWLSSA-N

Properties

• Density: 1.751g/cm³ (Cal.)
• Boiling point: 783.408°C at 760 mmHg (Cal.)
• Flash point: 427.59°C (Cal.)