Adenosine-5'-(4-Fluorosulfonylphenylphosphate)
[CAS# 60397-89-9]

Identification

• Name: Adenosine-5'-(4-Fluorosulfonylphenylphosphate)
• Synonyms: [(2R,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl (4-Fluorosulfonylphenyl) Hydrogen Phosphate; [(2R,3S,4R,5R)-5-(6-Amino-9-Purinyl)-3,4-Dihydroxy-2-Tetrahydrofuranyl]Methyl (4-Fluorosulfonylphenyl) Hydrogen Phosphate; [(2R,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Oxolan-2-Yl]Methyl (4-Fluorosulfonylphenyl) Hydrogen Phosphate
• Molecular Formula: C₁₆H₁₇FN₅O₉PS
• Molecular Weight: 505.37
• CAS Registry Number: 60397-89-9
• SMILES: [C@H]1(O[C@@H]([C@@H](O)[C@H]1O)CO[P](OC2=CC=C([S](F)(=O)=O)C=C2)(=O)O)[N]3C4=C(N=C3)C(=NC=N4)N
• InChI: 1S/C16H17FN5O9PS/c17-33(27,28)9-3-1-8(2-4-9)31-32(25,26)29-5-10-12(23)13(24)16(30-10)22-7-21-11-14(18)19-6-20-15(11)22/h1-4,6-7,10,12-13,16,23-24H,5H2,(H,25,26)(H2,18,19,20)/t10-,12-,13-,16-/m1/s1
• InChIKey: KEAQYRFZVLMXRW-XNIJJKJLSA-N

Properties

• Density: 2.024g/cm³ (Cal.)
• Boiling point: 804.534°C at 760 mmHg (Cal.)
• Flash point: 440.366°C (Cal.)