[(1S,2S,5R)-2-(6-Aminopurin-9-Yl)-5-(Hydroxymethyl)-1-Cyclopent-3-Enyl]Methanol
[CAS# 142187-88-0]

Identification

• Name: [(1S,2S,5R)-2-(6-Aminopurin-9-Yl)-5-(Hydroxymethyl)-1-Cyclopent-3-Enyl]Methanol
• Synonyms: [(1S,2S,5R)-2-(6-Amino-9-Purinyl)-5-(Hydroxymethyl)-1-Cyclopent-3-Enyl]Methanol; [(1S,2S,5R)-2-(6-Aminopurin-9-Yl)-5-Methylol-1-Cyclopent-3-Enyl]Methanol; 9-(4,5-Bishydroxymethylcyclopent-2-En-1-Yl)-9H-Adenine
• Molecular Formula: C₁₂H₁₅N₅O₂
• Molecular Weight: 261.28
• CAS Registry Number: 142187-88-0
• SMILES: [C@@H]3([N]1C2=C(N=C1)C(=NC=N2)N)[C@H]([C@@H](C=C3)CO)CO
• InChI: 1S/C12H15N5O2/c13-11-10-12(15-5-14-11)17(6-16-10)9-2-1-7(3-18)8(9)4-19/h1-2,5-9,18-19H,3-4H2,(H2,13,14,15)/t7-,8-,9-/m0/s1
• InChIKey: ZGCLIXGLQFSZRB-CIUDSAMLSA-N

Properties

• Density: 1.669g/cm³ (Cal.)
• Boiling point: 556.174°C at 760 mmHg (Cal.)
• Flash point: 290.164°C (Cal.)