(3,4,5-Trihydroxy-6-Methyl-Oxan-2-Yl)Oxyphosphonic Acid
[CAS# 16562-58-6]

Identification

• Name: (3,4,5-Trihydroxy-6-Methyl-Oxan-2-Yl)Oxyphosphonic Acid
• Synonyms: [(3S,4R,5S,6S)-3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl] Dihydrogen Phosphate; [(3S,4R,5S,6S)-3,4,5-Trihydroxy-6-Methyl-2-Tetrahydropyranyl] Dihydrogen Phosphate; [(3S,4R,5S,6S)-3,4,5-Trihydroxy-6-Methyl-Oxan-2-Yl] Dihydrogen Phosphate
• Molecular Formula: C₆H₁₃O₈P
• Molecular Weight: 244.14
• CAS Registry Number: 16562-58-6
• SMILES: [C@H]1(C(O[C@H]([C@H]([C@H]1O)O)C)O[P](=O)(O)O)O
• InChI: 1S/C6H13O8P/c1-2-3(7)4(8)5(9)6(13-2)14-15(10,11)12/h2-9H,1H3,(H2,10,11,12)/t2-,3+,4+,5-,6?/m0/s1
• InChIKey: PTVXQARCLQPGIR-DHVFOXMCSA-N

Properties

• Density: 1.757g/cm³ (Cal.)
• Boiling point: 519.425°C at 760 mmHg (Cal.)
• Flash point: 267.939°C (Cal.)