dineodymium(3+) ion trioxalate

• ChemBase ID: 107384
• Molecular Formular: C6Nd2O12
• Molecular Mass: 552.537
• Monoisotopic Mass: 547.75442144
• SMILES: [Nd+3].[Nd+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-].[Nd+3].[Nd+3]
• InChI: InChI=1S/3C2H2O4.2Nd/c3*3-1(4)2(5)6;;/h3*(H,3,4)(H,5,6);;/q;;;2*+3/p-6
• InChIKey: VKLDOHAGZQSOPP-UHFFFAOYSA-H

NAMES AND DATABASE IDS

Names

• IUPAC name: dineodymium(3+) ion trioxalate
• IUPAC Traditional name: dineodymium(3+) ion trioxalate ion
• Synonyms: NEODYMIUM OXALATE

Database IDs

• CAS Number: 1186-50-1
• EC Number: 214-692-9
• PubChem SID: 162093209
• PubChem CID: 164794

CALCULATED PROPERTIES

• 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
• Acid pKa: 1.3639908
• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): -5.101814
• LogD (pH = 7.4): -6.8848467

PROPERTIES

Product Information

• Purity: 99.9%

DETAILS

MP Biomedicals - 05203502

MP Biomedicals Rare Chemical collection