(2R,5R)-5-(6-Aminopurin-9-Yl)-3-(1-Hydroxyethyl)Cyclopent-3-Ene-1,2-Diol
[CAS# 138571-54-7]

Identification

• Name: (2R,5R)-5-(6-Aminopurin-9-Yl)-3-(1-Hydroxyethyl)Cyclopent-3-Ene-1,2-Diol
• Synonyms: (2R,5R)-5-(6-Amino-9-Purinyl)-3-(1-Hydroxyethyl)Cyclopent-3-Ene-1,2-Diol; 3-Cyclopentene-1,2-Diol, 5-(6-Amino-9H-Purin-9-Yl)-3-(1-Hydroxyethyl)-, (1S-(1Alpha,2Alpha,3(S*),5Beta))-; 6'-C-Methylneplanocin A
• Molecular Formula: C₁₂H₁₅N₅O₃
• Molecular Weight: 277.28
• CAS Registry Number: 138571-54-7
• SMILES: [C@H]3([N]1C2=C(N=C1)C(=NC=N2)N)C(O)[C@H](O)C(=C3)[C@H](O)C
• InChI: 1S/C12H15N5O3/c1-5(18)6-2-7(10(20)9(6)19)17-4-16-8-11(13)14-3-15-12(8)17/h2-5,7,9-10,18-20H,1H3,(H2,13,14,15)/t5-,7-,9-,10?/m1/s1
• InChIKey: CDKUWLLYHVOVCD-IECXKTIHSA-N

Properties

• Density: 1.813g/cm³ (Cal.)
• Boiling point: 615.852°C at 760 mmHg (Cal.)
• Flash point: 326.256°C (Cal.)