5-Hydroxy-4-(Hydroxymethyl)-6-Methyl-3-Pyridylmethyl Dihydrogen Phosphate
[CAS# 447-05-2]

Identification

• Name: 5-Hydroxy-4-(Hydroxymethyl)-6-Methyl-3-Pyridylmethyl Dihydrogen Phosphate
• Synonyms: [5-Hydroxy-4-(Hydroxymethyl)-6-Methyl-3-Pyridyl]Methyl Dihydrogen Phosphate; (5-Hydroxy-6-Methyl-4-Methylol-3-Pyridyl)Methyl Dihydrogen Phosphate; [5-Hydroxy-4-(Hydroxymethyl)-6-Methyl-Pyridin-3-Yl]Methyl Dihydrogen Phosphate
• Molecular Formula: C₈H₁₂NO₆P
• Molecular Weight: 249.16
• CAS Registry Number: 447-05-2
• EINECS: 207-179-6
• SMILES: C1=C(C(=C(C(=N1)C)O)CO)CO[P](=O)(O)O
• InChI: 1S/C8H12NO6P/c1-5-8(11)7(3-10)6(2-9-5)4-15-16(12,13)14/h2,10-11H,3-4H2,1H3,(H2,12,13,14)
• InChIKey: WHOMFKWHIQZTHY-UHFFFAOYSA-N

Properties

• Density: 1.628g/cm³ (Cal.)
• Boiling point: 638.498°C at 760 mmHg (Cal.)
• Flash point: 339.952°C (Cal.)