3'-(1-Butylphosphoryl)Adenosine
[CAS# 52278-63-4]

Identification

• Name: 3'-(1-Butylphosphoryl)Adenosine
• Synonyms: [(2R,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-4-Hydroxy-2-(Hydroxymethyl)Tetrahydrofuran-3-Yl] Butyl Hydrogen Phosphate; [(2R,3S,4R,5R)-5-(6-Amino-9-Purinyl)-4-Hydroxy-2-(Hydroxymethyl)-3-Tetrahydrofuranyl] Butyl Hydrogen Phosphate; [(2R,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-4-Hydroxy-2-Methylol-Tetrahydrofuran-3-Yl] Butyl Hydrogen Phosphate
• Molecular Formula: C₁₄H₂₂N₅O₇P
• Molecular Weight: 403.33
• CAS Registry Number: 52278-63-4
• SMILES: [C@H]1(O[C@@H]([C@@H](O[P](OCCCC)(=O)O)[C@H]1O)CO)[N]2C3=C(N=C2)C(=NC=N3)N
• InChI: 1S/C14H22N5O7P/c1-2-3-4-24-27(22,23)26-11-8(5-20)25-14(10(11)21)19-7-18-9-12(15)16-6-17-13(9)19/h6-8,10-11,14,20-21H,2-5H2,1H3,(H,22,23)(H2,15,16,17)/t8-,10-,11-,14-/m1/s1
• InChIKey: RVVKQBUWQFREIE-IDTAVKCVSA-N

Properties

• Density: 1.815g/cm³ (Cal.)
• Boiling point: 713.206°C at 760 mmHg (Cal.)
• Flash point: 385.133°C (Cal.)