dierbium(3+) ion decahydrate trioxalate

• ChemBase ID: 107337
• Molecular Formular: C6H20Er2O22
• Molecular Mass: 778.7278
• Monoisotopic Mass: 775.90520828
• SMILES: O.O.O.O.O.O.O.O.O.O.[Er+3].[Er+3].[O-]C(=O)C(=O)[O-].[O-]C(=O)C(=O)[O-].[O-]C(=O)C(=O)[O-]
• Canonical SMILES: [O-]C(=O)C(=O)[O-].[O-]C(=O)C(=O)[O-].[O-]C(=O)C(=O)[O-].O.O.O.O.O.O.O.O.O.O.[Er+3].[Er+3]
• InChI: InChI=1S/3C2H2O4.2Er.10H2O/c3*3-1(4)2(5)6;;;;;;;;;;;;/h3*(H,3,4)(H,5,6);;;10*1H2/q;;;2*+3;;;;;;;;;;/p-6
• InChIKey: OVECSXKDHFDFMD-UHFFFAOYSA-H

NAMES AND DATABASE IDS

Names

• IUPAC name: dierbium(3+) ion decahydrate trioxalate
• IUPAC Traditional name: dierbium(3+) ion decahydrate trioxalate ion
• Synonyms: ERBIUM OXALATE

Database IDs

• CAS Number: 30618-31-6
• PubChem SID: 162094555
• PubChem CID: 25021616

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

Product Information

• Purity: 99.9%

DETAILS

MP Biomedicals - 05203368

MP Biomedicals Rare Chemical collection