[(2R,3S,5R)-5-(6-Aminopurin-9-Yl)-3-Hydroxyoxolan-2-Yl]Methyl 4-Fluorosulfonylbenzoate
[CAS# 126463-19-2]

Identification

• Name: [(2R,3S,5R)-5-(6-Aminopurin-9-Yl)-3-Hydroxyoxolan-2-Yl]Methyl 4-Fluorosulfonylbenzoate
• Synonyms: [(2R,3S,5R)-5-(6-Aminopurin-9-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl 4-Fluorosulfonylbenzoate; 4-Fluorosulfonylbenzoic Acid [(2R,3S,5R)-5-(6-Amino-9-Purinyl)-3-Hydroxy-2-Tetrahydrofuranyl]Methyl Ester; 4-Fluorosulfonylbenzoic Acid [(2R,3S,5R)-5-(6-Aminopurin-9-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Ester
• Molecular Formula: C₁₇H₁₆FN₅O₆S
• Molecular Weight: 437.40
• CAS Registry Number: 126463-19-2
• SMILES: [C@@H]2(COC(C1=CC=C(C=C1)[S](=O)(=O)F)=O)[C@@H](O)C[C@@H](O2)[N]3C=NC4=C3N=CN=C4N
• InChI: 1S/C17H16FN5O6S/c18-30(26,27)10-3-1-9(2-4-10)17(25)28-6-12-11(24)5-13(29-12)23-8-22-14-15(19)20-7-21-16(14)23/h1-4,7-8,11-13,24H,5-6H2,(H2,19,20,21)/t11-,12+,13+/m0/s1
• InChIKey: LHCIYNNCZKYAFR-YNEHKIRRSA-N

Properties

• Density: 1.789g/cm³ (Cal.)
• Boiling point: 721.264°C at 760 mmHg (Cal.)
• Flash point: 390.007°C (Cal.)