2-Amino-9-[(2S,5R)-2-(Hydroxymethyl)-1,3-Oxathiolan-5-Yl]-9H-Purin-6-Ol
[CAS# 149819-75-0]

Identification

• Name: 2-Amino-9-[(2S,5R)-2-(Hydroxymethyl)-1,3-Oxathiolan-5-Yl]-9H-Purin-6-Ol
• Synonyms: (-)-(2S,5R)-9-(2-(Hydroxymethyl)-1,3-oxathiolan-5-yl)guanine; (-)-(2S,5R)-9-[2-(Hydroxymethyl)-1,3-oxathiolan-5-yl]guanine; (+)-(2S,5S)-9-(2-(Hydroxymethyl)-1,3-oxathiolan-5-yl)guanine
• Molecular Formula: C₉H₁₁N₅O₃S
• Molecular Weight: 269.28
• CAS Registry Number: 149819-75-0
• SMILES: C1[C@@H](O[C@@H](S1)CO)N2C=NC3=C2N=C(N=C3O)N
• InChI: 1S/C9H11N5O3S/c10-9-12-7-6(8(16)13-9)11-3-14(7)4-2-18-5(1-15)17-4/h3-5,15H,1-2H2,(H3,10,12,13,16)/t4-,5+/m1/s1
• InChIKey: VIUJWDGLDRZXDG-UHNVWZDZSA-N

Properties

• Density: 2.1±0.1g/cm³ (Cal.)
• Boiling point: 721.5±70.0°C at 760 mmHg (Cal.)
• Flash point: 390.2±35.7°C (Cal.)
• Refractive index: 1.947 (Cal.)