iron(3+) ion triphosphinate

• ChemBase ID: 110655
• Molecular Formular: FeH6O6P3
• Molecular Mass: 250.810323
• Monoisotopic Mass: 250.8726603
• SMILES: [Fe+3].[O-]P=O.[O-]P=O.[O-]P=O
• Canonical SMILES: [O-]P=O.[O-]P=O.[O-]P=O.[Fe+3]
• InChI: InChI=1S/Fe.3HO2P/c;3*1-3-2/h;3*(H,1,2)/q+3;;;/p-3
• InChIKey: AKUPWWXXOPZGCK-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: iron(3+) ion triphosphinate
• IUPAC Traditional name: ferric iron trihypophosphite
• Synonyms: FERRIC HYPOPHOSPHITE

Database IDs

• CAS Number: 7783-84-8
• PubChem SID: 162089256
• PubChem CID: 22991897

CALCULATED PROPERTIES

• Acid pKa: -4.0671873
• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -2.8514
• LogD (pH = 7.4): -2.8514
• Log P: -0.5876
• Molar Refractivity: 8.0858 cm^3
• Polarizability: 3.9117465 Å^3
• Polar Surface Area: 40.13 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

DETAILS

MP Biomedicals - 05215844

MP Biomedicals Rare Chemical collection