λ4-cerium(4+) ion tetraammonium tetrasulfate

• ChemBase ID: 157292
• Molecular Formular: CeH16N4O16S4
• Molecular Mass: 596.52024
• Monoisotopic Mass: 595.84985245
• SMILES: [NH4+].[NH4+].[NH4+].[NH4+].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Ce+4]
• Canonical SMILES: [O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[NH4+].[NH4+].[NH4+].[NH4+].[Ce+4]
• InChI: InChI=1S/Ce.4H3N.4H2O4S/c;;;;;4*1-5(2,3)4/h;4*1H3;4*(H2,1,2,3,4)/q+4;;;;;;;;/p-4
• InChIKey: OKJMLYFJRFYBPS-UHFFFAOYSA-J

NAMES AND DATABASE IDS

Names

• IUPAC name: λ^4-cerium(4+) ion tetraammonium tetrasulfate
• IUPAC Traditional name: λ^4-cerium(4+) ion tetraammonium tetrasulfate
• Synonyms: Cerium(IV) ammonium sulfate solution; Ammonium cerium(IV) sulfate solution; Cerium(IV) ammonium sulfate 溶液; 硫酸铈(IV)铵 溶液

Database IDs

• CAS Number: 7637-03-8
• MDL Number: MFCD00148851
• PubChem SID: 162251429; 24863631
• PubChem CID: 10930035

CALCULATED PROPERTIES

• Acid pKa: -3.034349
• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): -5.569452
• LogD (pH = 7.4): -5.594027
• Log P: -0.841552
• Molar Refractivity: 11.5274 cm^3
• Polarizability: 6.037845 Å^3
• Polar Surface Area: 80.26 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/38
• Safety Statements: 26
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319
• GHS Precautionary statements: P305 + P351 + P338
• Personal Protective Equipment: Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

Product Information

• Concentration: 0.1 M Ce(NH4)4(SO4)4
• Grade: Reag. Ph. Eur.
• Quality: volumetric
• Factor: 1.000 ±0.001
• Empirical Formula (Hill Notation): H16CeN4O16S4

DETAILS

Sigma Aldrich - 37941

General description
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