[5,5,5-Trichloro-1,3-Dihydroxy-3-(2,2,2-Trichloroethyl)Pentan-2-Yl]Phosphonic Acid
[CAS# 120287-10-7]

Identification

• Name: [5,5,5-Trichloro-1,3-Dihydroxy-3-(2,2,2-Trichloroethyl)Pentan-2-Yl]Phosphonic Acid
• Synonyms: [4,4,4-Trichloro-2-Hydroxy-1-(Hydroxymethyl)-2-(2,2,2-Trichloroethyl)Butyl]Phosphonic Acid; [4,4,4-Trichloro-2-Hydroxy-1-Methylol-2-(2,2,2-Trichloroethyl)Butyl]Phosphonic Acid; 1-Bis(Trichloroethyl)Phosphoryl-1,3-Propanediol
• Molecular Formula: C₇H₁₁Cl₆O₅P
• Molecular Weight: 418.85
• CAS Registry Number: 120287-10-7
• SMILES: C(C(C(O)(CC(Cl)(Cl)Cl)CC(Cl)(Cl)Cl)[P](=O)(O)O)O
• InChI: 1S/C7H11Cl6O5P/c8-6(9,10)2-5(15,3-7(11,12)13)4(1-14)19(16,17)18/h4,14-15H,1-3H2,(H2,16,17,18)
• InChIKey: YZXBXARBRHOBOM-UHFFFAOYSA-N

Properties

• Density: 1.844g/cm³ (Cal.)
• Boiling point: 719.915°C at 760 mmHg (Cal.)
• Flash point: 389.191°C (Cal.)