bis($l^{2}-lead(2+) ion) (phosphonatooxy)phosphonate

• ChemBase ID: 107954
• Molecular Formular: O7P2Pb2
• Molecular Mass: 588.343322
• Monoisotopic Mass: 589.8652296
• SMILES: [Pb+2].[Pb+2].[O-]P(=O)([O-])OP(=O)([O-])[O-]
• Canonical SMILES: [O-]P(=O)(OP(=O)([O-])[O-])[O-].[Pb+2].[Pb+2]
• InChI: InChI=1S/H4O7P2.2Pb/c1-8(2,3)7-9(4,5)6;;/h(H2,1,2,3)(H2,4,5,6);;/q;2*+2/p-4
• InChIKey: CDZXKKXSZAMHFU-UHFFFAOYSA-J

NAMES AND DATABASE IDS

Names

• IUPAC name: bis($l^{2}-lead(2+) ion) (phosphonatooxy)phosphonate
• IUPAC Traditional name: bis($l^{2}-lead(2+) ion) diphosphate
• Synonyms: LEAD PYROPHOSPHATE

Database IDs

• CAS Number: 13453-66-2
• PubChem SID: 162088344
• PubChem CID: 61611

CALCULATED PROPERTIES

• Log P: -1.4419023
• Molar Refractivity: 21.038 cm^3
• Polarizability: 10.301113 Å^3
• Polar Surface Area: 135.61 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: false
• Acid pKa: 1.7026764
• H Acceptors: 6
• H Donor: 0
• LogD (pH = 5.5): -5.945248
• LogD (pH = 7.4): -6.9029593

PROPERTIES

Physical Property

• Melting Point: 824°C

Safety Information

• European Hazard Symbols: Irritant (Xi)
• Risk Statements: R:36/37/38
• Safety Statements: S:20-25-26-37/39

DETAILS

MP Biomedicals - 05205589

MP Biomedicals Rare Chemical collection