1-[4-(6-Aminopurin-9-Yl)-1-Cyclopent-2-Enyl]Ethane-1,2-Diol
[CAS# 148179-99-1]

Identification

• Name: 1-[4-(6-Aminopurin-9-Yl)-1-Cyclopent-2-Enyl]Ethane-1,2-Diol
• Synonyms: 1-[4-(6-Amino-9-Purinyl)-1-Cyclopent-2-Enyl]Ethane-1,2-Diol; 9-(4-(1,2-Dihydroxyethyl)Cyclopent-2-En-1-Yl)-9H-Adenine; 9-(C-4-(1,2-Dihydroxyethyl)Cyclopent-2-En-R-1-Yl)-9H-Adenine
• Molecular Formula: C₁₂H₁₅N₅O₂
• Molecular Weight: 261.28
• CAS Registry Number: 148179-99-1
• SMILES: C1=NC2=C(C(=N1)N)N=C[N]2C3C=CC(C3)C(CO)O
• InChI: 1S/C12H15N5O2/c13-11-10-12(15-5-14-11)17(6-16-10)8-2-1-7(3-8)9(19)4-18/h1-2,5-9,18-19H,3-4H2,(H2,13,14,15)
• InChIKey: GPDOSRMBOXOSCD-UHFFFAOYSA-N

Properties

• Density: 1.669g/cm³ (Cal.)
• Boiling point: 596.514°C at 760 mmHg (Cal.)
• Flash point: 314.561°C (Cal.)