[(3S,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxyphosphonic Acid
[CAS# 63779-58-8]

Identification

• Name: [(3S,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxyphosphonic Acid
• Synonyms: [(3S,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl] Dihydrogen Phosphate; [(3S,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl] Dihydrogen Phosphate; [(3S,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl] Dihydrogen Phosphate
• Molecular Formula: C₆H₁₃O₉P
• Molecular Weight: 260.14
• CAS Registry Number: 63779-58-8
• SMILES: [C@H]1(C(O[C@@H]([C@H]([C@@H]1O)O)CO)O[P](=O)(O)O)O
• InChI: 1S/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5+,6?/m1/s1
• InChIKey: HXXFSFRBOHSIMQ-QTVWNMPRSA-N

Properties

• Density: 1.906g/cm³ (Cal.)
• Boiling point: 602.991°C at 760 mmHg (Cal.)
• Flash point: 318.478°C (Cal.)