disamarium(3+) ion tricarbonate

• ChemBase ID: 111250
• Molecular Formular: C3O9Sm2
• Molecular Mass: 480.7467
• Monoisotopic Mass: 483.79369558
• SMILES: [Sm+3].[Sm+3].[O-]C(=O)[O-].[O-]C(=O)[O-].[O-]C(=O)[O-]
• Canonical SMILES: [O-]C(=O)[O-].[O-]C(=O)[O-].[O-]C(=O)[O-].[Sm+3].[Sm+3]
• InChI: InChI=1S/3CH2O3.2Sm/c3*2-1(3)4;;/h3*(H2,2,3,4);;/q;;;2*+3/p-6
• InChIKey: QCZFMLDHLOYOQJ-UHFFFAOYSA-H

NAMES AND DATABASE IDS

Names

• IUPAC name: disamarium(3+) ion tricarbonate
• IUPAC Traditional name: disamarium(3+) ion tricarbonate; disamarium(3+) ion triCO3
• Synonyms: Samarium(III) carbonate hydrate, REacton®; SAMARIUM CARBONATE; 水合碳酸钐(III), REacton®

Database IDs

• CAS Number: 38245-37-3
• EC Number: 227-581-5
• MDL Number: MFCD00150444
• PubChem SID: 162106478
• PubChem CID: 165370

CALCULATED PROPERTIES

• Acid pKa: 6.0525417
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 0.142811
• LogD (pH = 7.4): -1.1138874
• Log P: 0.25005138
• Molar Refractivity: 31.1724 cm^3
• Polarizability: 3.6386902 Å^3
• Polar Surface Area: 63.19 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Powder
• Melting Point: >500°C dec.

Safety Information

• Storage Warning: Hygroscopic
• TSCA Listed: 是

Product Information

• Purity: 99.9%; 99.99% (REO)

DETAILS

MP Biomedicals - 05218356

MP Biomedicals Rare Chemical collection