cerium(3+) ion hydrate fluoride

• ChemBase ID: 94356
• Molecular Formular: CeFO++
• Molecular Mass: 175.1138032
• Monoisotopic Mass: 174.89875584
• SMILES: [F-].[Ce+3].O
• Canonical SMILES: O.[F-].[Ce+3]
• InChI: InChI=1S/Ce.FH.H2O/h;1H;1H2/q+3;;/p-1
• InChIKey: FJQGTCOLGUHKBD-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: cerium(3+) ion hydrate fluoride
• IUPAC Traditional name: cerium(3+) hydrate fluoride
• Synonyms: Cerium(III) fluoride, hydrate 98%

Database IDs

• CAS Number: 33317-01-4
• MDL Number: MFCD00149643
• PubChem SID: 162081010
• PubChem CID: 44717258

CALCULATED PROPERTIES

• Acid pKa: 3.17
• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 0.3684526
• LogD (pH = 7.4): 0.36924794
• Log P: 0.14883864
• Molar Refractivity: 0.8725 cm^3
• Polarizability: 0.45069772 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 1460°C

Safety Information

• Storage Warning: Harmful