1-(2'-Deoxy-beta-Threopentofuranosyl)Adenine
[CAS# 13276-53-4]

Identification

• Name: 1-(2'-Deoxy-beta-Threopentofuranosyl)Adenine
• Synonyms: (2R,3R,5R)-5-(6-Aminopurin-9-Yl)-2-(Hydroxymethyl)Tetrahydrofuran-3-Ol; (2R,3R,5R)-5-(6-Amino-9-Purinyl)-2-(Hydroxymethyl)-3-Tetrahydrofuranol; (2R,3R,5R)-5-(6-Aminopurin-9-Yl)-2-Methylol-Tetrahydrofuran-3-Ol
• Molecular Formula: C₁₀H₁₃N₅O₃
• Molecular Weight: 251.24
• CAS Registry Number: 13276-53-4
• SMILES: [C@@H]3([N]1C2=C(N=C1)C(=NC=N2)N)O[C@@H]([C@@H](C3)O)CO
• InChI: 1S/C10H13N5O3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(17)6(2-16)18-7/h3-7,16-17H,1-2H2,(H2,11,12,13)/t5-,6-,7-/m1/s1
• InChIKey: OLXZPDWKRNYJJZ-FSDSQADBSA-N

Properties

• Density: 1.92g/cm³ (Cal.)
• Melting point: 191°C (Expl.)
• Boiling point: 627.155°C at 760 mmHg (Cal.)
• Flash point: 333.091°C (Cal.)