trisodium trioxophosphinate

• ChemBase ID: 303896
• Molecular Formular: Na3O9P3
• Molecular Mass: 305.885193
• Monoisotopic Mass: 305.84482431
• SMILES: [O-]P(=O)=O.[O-]P(=O)=O.[O-]P(=O)=O.[Na+].[Na+].[Na+]
• Canonical SMILES: [O-]P(=O)=O.[O-]P(=O)=O.[O-]P(=O)=O.[Na+].[Na+].[Na+]
• InChI: InChI=1S/3Na.3HO3P/c;;;3*1-4(2)3/h;;;3*(H,1,2,3)/q3*+1;;;/p-3
• InChIKey: PYPLIJLXHBBACZ-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: trisodium trioxophosphinate
• IUPAC Traditional name: trisodium tris(trioxidophosphate(1-))
• Synonyms: Sodium metaphosphate; Sodium phosphate (meta); Sodium trimetaphosphate; 三偏磷酸钠

Database IDs

• CAS Number: 7785-84-4
• EC Number: 232-088-3
• MDL Number: MFCD00867826
• Merck Index: 148696

CALCULATED PROPERTIES

• Acid pKa: -2.0
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): -3.1719975
• LogD (pH = 7.4): -3.172
• Log P: -0.9082
• Molar Refractivity: 11.1647 cm^3
• Polarizability: 4.634388 Å^3
• Polar Surface Area: 57.2 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Powder
• Density: 2.49

Safety Information

• TSCA Listed: 是
• GHS Hazard statements: H313
• GHS Precautionary statements: P312