Cyclaradine-5'-Methoxyacetate
[CAS# 81566-77-0]

Identification

• Name: Cyclaradine-5'-Methoxyacetate
• Synonyms: [(1R,2R,3R,4R)-4-(6-Aminopurin-9-Yl)-2,3-Dihydroxy-Cyclopentyl]Methyl 2-Methoxyacetate; 2-Methoxyacetic Acid [(1R,2R,3R,4R)-4-(6-Amino-9-Purinyl)-2,3-Dihydroxycyclopentyl]Methyl Ester; 2-Methoxyacetic Acid [(1R,2R,3R,4R)-4-(6-Aminopurin-9-Yl)-2,3-Dihydroxy-Cyclopentyl]Methyl Ester
• Molecular Formula: C₁₄H₁₉N₅O₅
• Molecular Weight: 337.33
• CAS Registry Number: 81566-77-0
• SMILES: [C@H]3([N]1C2=C(N=C1)C(=NC=N2)N)[C@@H](O)[C@H](O)[C@H](C3)COC(=O)COC
• InChI: 1S/C14H19N5O5/c1-23-4-9(20)24-3-7-2-8(12(22)11(7)21)19-6-18-10-13(15)16-5-17-14(10)19/h5-8,11-12,21-22H,2-4H2,1H3,(H2,15,16,17)/t7-,8-,11-,12-/m1/s1
• InChIKey: HAQPOLYTOAILTO-GAJNKVMBSA-N

Properties

• Density: 1.703g/cm³ (Cal.)
• Boiling point: 616.217°C at 760 mmHg (Cal.)
• Flash point: 326.476°C (Cal.)