$l^{2}-lead(2+) ion bis(1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-olate)

• ChemBase ID: 97956
• Molecular Formular: C10H2F12O4Pb
• Molecular Mass: 621.3013184
• Monoisotopic Mass: 621.95279918
• SMILES: [O-]/C(=C\C(=O)C(F)(F)F)/C(F)(F)F.[Pb+2].[O-]/C(=C\C(=O)C(F)(F)F)/C(F)(F)F
• Canonical SMILES: [O-]/C(=C\C(=O)C(F)(F)F)/C(F)(F)F.[O-]/C(=C\C(=O)C(F)(F)F)/C(F)(F)F.[Pb+2]
• InChI: InChI=1S/2C5H2F6O2.Pb/c2*6-4(7,8)2(12)1-3(13)5(9,10)11;/h2*1,12H;/q;;+2/p-2
• InChIKey: VPDFYHDIFAQDGC-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: $l^{2}-lead(2+) ion bis(1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-olate)
• IUPAC Traditional name: $l^{2}-lead(2+) ion bis(1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-olate)
• Synonyms: Lead(II) hexafluoroacetylacetonate 98%

Database IDs

• CAS Number: 19648-88-5
• MDL Number: MFCD00058833
• PubChem SID: 162084433
• PubChem CID: 5708555

CALCULATED PROPERTIES

• Acid pKa: 2.7387822
• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -0.61847794
• LogD (pH = 7.4): -1.4234238
• Log P: 2.0751166
• Molar Refractivity: 40.9013 cm^3
• Polarizability: 10.132205 Å^3
• Polar Surface Area: 40.13 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• Storage Warning: Toxic