(2,5-Diphosphonooxyphenyl) Dihydrogen Phosphate
[CAS# 147527-30-8]

Identification

• Name: (2,5-Diphosphonooxyphenyl) Dihydrogen Phosphate
• Synonyms: Benzene 1,2,4-Trisphosphate; Bzp3-1,2,4
• Molecular Formula: C₆H₉O₁₂P₃
• Molecular Weight: 366.05
• CAS Registry Number: 147527-30-8
• SMILES: C1=C(C(=CC=C1O[P](=O)(O)O)O[P](=O)(O)O)O[P](=O)(O)O
• InChI: 1S/C6H9O12P3/c7-19(8,9)16-4-1-2-5(17-20(10,11)12)6(3-4)18-21(13,14)15/h1-3H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)
• InChIKey: XPWCRVGWWKLQCK-UHFFFAOYSA-N

Properties

• Density: 2.161g/cm³ (Cal.)
• Boiling point: 777.939°C at 760 mmHg (Cal.)
• Flash point: 424.282°C (Cal.)