diytterbium(3+) ion trioxalate

• ChemBase ID: 302955
• Molecular Formular: C6O12Yb2
• Molecular Mass: 610.165
• Monoisotopic Mass: 611.81669944
• SMILES: C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Yb+3].[Yb+3]
• Canonical SMILES: [O-]C(=O)C(=O)[O-].[O-]C(=O)C(=O)[O-].[O-]C(=O)C(=O)[O-].[Yb+3].[Yb+3]
• InChI: InChI=1S/3C2H2O4.2Yb/c3*3-1(4)2(5)6;;/h3*(H,3,4)(H,5,6);;/q;;;2*+3/p-6
• InChIKey: FLJKBWKLGAYSFH-UHFFFAOYSA-H

NAMES AND DATABASE IDS

Names

• IUPAC name: diytterbium(3+) ion trioxalate
• IUPAC Traditional name: diytterbium(3+) ion trioxalate
• Synonyms: Ytterbium(III) oxalate hydrate, REacton®; Ytterbium(III) oxalate decahydrate, REacton®; 水合草酸镱(III), REacton®; 十水合草酸镱(III), REacton®

Database IDs

• CAS Number: 51373-68-3; 58176-74-2
• MDL Number: MFCD00150498; MFCD00050806

CALCULATED PROPERTIES

• Acid pKa: 1.3639908
• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): -5.101814
• LogD (pH = 7.4): -6.8848467
• Log P: -0.26375157
• Molar Refractivity: 36.1128 cm^3
• Polarizability: 5.6277657 Å^3
• Polar Surface Area: 80.26 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Apperance: Crystalline

Safety Information

• European Hazard Symbols: X
• UN Number: UN3288
• Hazard Class: 6.1
• Packing Group: III
• Risk Statements: 21/22
• Safety Statements: 24/25
• TSCA Listed: 是
• GHS Pictograms: GHS07
• GHS Hazard statements: H302-H312
• GHS Precautionary statements: P280-P302+P352-P322-P301+P312-P312-P501A

Product Information

• Purity: 99.9% (REO); 99.99% (REO)