9-((2-Methyl-4-Methylene-5-Oxotetrahydrofuran-2-Yl)Methyl)Hypoxanthine
[CAS# 100682-44-8]

Identification

• Name: 9-((2-Methyl-4-Methylene-5-Oxotetrahydrofuran-2-Yl)Methyl)Hypoxanthine
• Synonyms: 9-[(2-Methyl-4-Methylene-5-Oxo-Tetrahydrofuran-2-Yl)Methyl]-3H-Purin-6-One; 9-[(2-Methyl-4-Methylene-5-Oxo-2-Tetrahydrofuranyl)Methyl]-3H-Purin-6-One; 9-[(5-Keto-2-Methyl-4-Methylene-Tetrahydrofuran-2-Yl)Methyl]-3H-Purin-6-One
• Molecular Formula: C₁₂H₁₂N₄O₃
• Molecular Weight: 260.25
• CAS Registry Number: 100682-44-8
• SMILES: C1=NC3=C([N]1CC2(OC(=O)C(C2)=C)C)NC=NC3=O
• InChI: 1S/C12H12N4O3/c1-7-3-12(2,19-11(7)18)4-16-6-15-8-9(16)13-5-14-10(8)17/h5-6H,1,3-4H2,2H3,(H,13,14,17)
• InChIKey: DKGIDXRLFYRRKD-UHFFFAOYSA-N

Properties

• Density: 1.532g/cm³ (Cal.)
• Boiling point: 597.558°C at 760 mmHg (Cal.)
• Flash point: 315.192°C (Cal.)