2-Amino-9-[3,4-Dihydroxy-5-(Hydroxymethyl)Oxolan-2-Yl]-1-Methylpurin-6-One
[CAS# 2140-65-0]

Identification

• Name: 2-Amino-9-[3,4-Dihydroxy-5-(Hydroxymethyl)Oxolan-2-Yl]-1-Methylpurin-6-One
• Synonyms: 2-Amino-9-[3,4-Dihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-1-Methyl-Purin-6-One; 2-Amino-9-[3,4-Dihydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]-1-Methyl-6-Purinone; 2-Amino-9-(3,4-Dihydroxy-5-Methylol-Tetrahydrofuran-2-Yl)-1-Methyl-Purin-6-One
• Molecular Formula: C₁₁H₁₅N₅O₅
• Molecular Weight: 297.27
• CAS Registry Number: 2140-65-0
• SMILES: C1=NC3=C([N]1C2OC(CO)C(C2O)O)N=C(N)N(C3=O)C
• InChI: 1S/C11H15N5O5/c1-15-9(20)5-8(14-11(15)12)16(3-13-5)10-7(19)6(18)4(2-17)21-10/h3-4,6-7,10,17-19H,2H2,1H3,(H2,12,14)
• InChIKey: UTAIYTHAJQNQDW-UHFFFAOYSA-N

Properties

• Density: 2.026g/cm³ (Cal.)
• Boiling point: 737.365°C at 760 mmHg (Cal.)
• Flash point: 399.744°C (Cal.)