P(1),P(2)-Bis(5'-Pyridoxal)Diphosphate
[CAS# 67279-83-8]

Identification

• Name: P(1),P(2)-Bis(5'-Pyridoxal)Diphosphate
• Synonyms: [(4-Formyl-5-Hydroxy-6-Methyl-3-Pyridyl)Methoxy-Hydroxy-Phosphoryl] (4-Formyl-5-Hydroxy-6-Methyl-3-Pyridyl)Methyl Hydrogen Phosphate; [(4-Formyl-5-Hydroxy-6-Methyl-3-Pyridyl)Methoxy-Hydroxyphosphoryl] (4-Formyl-5-Hydroxy-6-Methyl-3-Pyridyl)Methyl Hydrogen Phosphate; [Hydroxy-[(5-Hydroxy-4-Methanoyl-6-Methyl-Pyridin-3-Yl)Methoxy]Phosphoryl] (5-Hydroxy-4-Methanoyl-6-Methyl-Pyridin-3-Yl)Methyl Hydrogen Phosphate
• Molecular Formula: C₁₆H₁₈N₂O₁₁P₂
• Molecular Weight: 476.27
• CAS Registry Number: 67279-83-8
• SMILES: C1=NC(=C(O)C(=C1CO[P](O[P](OCC2=C(C(=C(N=C2)C)O)C=O)(=O)O)(=O)O)C=O)C
• InChI: 1S/C16H18N2O11P2/c1-9-15(21)13(5-19)11(3-17-9)7-27-30(23,24)29-31(25,26)28-8-12-4-18-10(2)16(22)14(12)6-20/h3-6,21-22H,7-8H2,1-2H3,(H,23,24)(H,25,26)
• InChIKey: AUVUJYCKFHLZTM-UHFFFAOYSA-N

Properties

• Density: 1.674g/cm³ (Cal.)
• Boiling point: 800.005°C at 760 mmHg (Cal.)
• Flash point: 437.628°C (Cal.)