Sodium [4-[(4-Phosphonooxyphenyl)-Pyridin-2-Ylmethyl]Phenyl] Dihydrogen Phosphate
[CAS# 36175-05-0]

Identification

• Name: Sodium [4-[(4-Phosphonooxyphenyl)-Pyridin-2-Ylmethyl]Phenyl] Dihydrogen Phosphate
• Synonyms: Sodium [4-[(4-Phosphonooxyphenyl)-(2-Pyridyl)Methyl]Phenyl] Dihydrogen Phosphate; Sodium [4-[(4-Phosphonooxyphenyl)-Pyridin-2-Yl-Methyl]Phenyl] Dihydrogen Phosphate; 4,4'-Pyridylmethylene)Diphenol Bis(Dihydrogen Phosphate) Tetrasodium Salt
• Molecular Formula: C₁₈H₁₇NNaO₈P₂
• Molecular Weight: 460.27
• CAS Registry Number: 36175-05-0
• SMILES: C3=C(C(C1=CC=C(O[P](O)(O)=O)C=C1)C2=NC=CC=C2)C=CC(=C3)O[P](O)(O)=O.[Na+]
• InChI: 1S/C18H17NO8P2.Na/c20-28(21,22)26-15-8-4-13(5-9-15)18(17-3-1-2-12-19-17)14-6-10-16(11-7-14)27-29(23,24)25;/h1-12,18H,(H2,20,21,22)(H2,23,24,25);/q;+1
• InChIKey: YIFRMXCLRHCEML-UHFFFAOYSA-N

Properties

• Boiling point: 688°C at 760 mmHg (Cal.)
• Flash point: 369.9°C (Cal.)