diytterbium(3+) ion octahydrate trisulfate

• ChemBase ID: 303018
• Molecular Formular: H16O20S3Yb2
• Molecular Mass: 778.41804
• Monoisotopic Mass: 779.81742991
• SMILES: O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Yb+3].[Yb+3]
• Canonical SMILES: [O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].O.O.O.O.O.O.O.O.[Yb+3].[Yb+3]
• InChI: InChI=1S/3H2O4S.8H2O.2Yb/c3*1-5(2,3)4;;;;;;;;;;/h3*(H2,1,2,3,4);8*1H2;;/q;;;;;;;;;;;2*+3/p-6
• InChIKey: MDOSIOHMOWGVIM-UHFFFAOYSA-H

NAMES AND DATABASE IDS

Names

• IUPAC name: diytterbium(3+) ion octahydrate trisulfate
• IUPAC Traditional name: diytterbium(3+) ion octahydrate trisulfate
• Synonyms: Ytterbium(III) sulfate octahydrate, REacton®; 八水合硫酸镱(III), REacton®

Database IDs

• CAS Number: 10034-98-7
• EC Number: 236-727-7
• MDL Number: MFCD00149887
• Merck Index: 1410105

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

Physical Property

• Apperance: Crystalline

Safety Information

• European Hazard Symbols: Irritant (Xi)
• Risk Statements: 36/37/38
• Safety Statements: 26-37
• TSCA Listed: 否
• GHS Pictograms: GHS07
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305+P351+P338-P302+P352-P321-P405-P501A

Product Information

• Purity: 99.9% (REO)