(8R,9R)-8-(Benzimidazol-1-Yl)-3-Hydroxy-3-Oxo-2,4,7-Trioxa-3lambda5-Phosphabicyclo[4.3.0]Nonan-9-Ol
[CAS# 76461-19-3]

Identification

• Name: (8R,9R)-8-(Benzimidazol-1-Yl)-3-Hydroxy-3-Oxo-2,4,7-Trioxa-3lambda5-Phosphabicyclo[4.3.0]Nonan-9-Ol
• Synonyms: (8R,9R)-8-(1-Benzimidazolyl)-3-Hydroxy-3-Oxo-2,4,7-Trioxa-3$L^{5}-Phosphabicyclo[4.3.0]Nonan-9-Ol; (8R,9R)-8-(Benzimidazol-1-Yl)-3-Hydroxy-3-Keto-2,4,7-Trioxa-3$L^{5}-Phosphabicyclo[4.3.0]Nonan-9-Ol; 1H-Benzimidazole, 1-(3,5-O-Phosphinico-Beta-D-Ribofuranosyl)-
• Molecular Formula: C₁₂H₁₃N₂O₆P
• Molecular Weight: 312.22
• CAS Registry Number: 76461-19-3
• SMILES: [C@H]4([N]1C=NC2=CC=CC=C12)[C@H](O)C3O[P](OCC3O4)(=O)O
• InChI: 1S/C12H13N2O6P/c15-10-11-9(5-18-21(16,17)20-11)19-12(10)14-6-13-7-3-1-2-4-8(7)14/h1-4,6,9-12,15H,5H2,(H,16,17)/t9?,10-,11?,12-/m1/s1
• InChIKey: IAVPOTOUQLKMJA-RUJICJSRSA-N

Properties

• Density: 1.963g/cm³ (Cal.)
• Boiling point: 589.707°C at 760 mmHg (Cal.)
• Flash point: 310.444°C (Cal.)