lutetium(3+) ion triacetate hydrate

• ChemBase ID: 106928
• Molecular Formular: C6H11LuO7
• Molecular Mass: 370.11414
• Monoisotopic Mass: 369.99124869
• SMILES: O.[Lu+3].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-]
• Canonical SMILES: [O-]C(=O)C.[O-]C(=O)C.[O-]C(=O)C.O.[Lu+3]
• InChI: InChI=1S/3C2H4O2.Lu.H2O/c3*1-2(3)4;;/h3*1H3,(H,3,4);;1H2/q;;;+3;/p-3
• InChIKey: ZMTOUBHBKDQYAB-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: lutetium(3+) ion triacetate hydrate
• IUPAC Traditional name: lutetium(3+) tris(acetate ion) hydrate; lutetium(3+) ion triacetate hydrate
• Synonyms: LUTECIUM ACETATE; Lutetium(III) acetate hydrate, REacton®; 乙酸镥(III), REacton®

Database IDs

• CAS Number: 18779-08-3; 207500-05-8
• EC Number: 242-566-3
• MDL Number: MFCD00211310
• PubChem SID: 162094572
• PubChem CID: 25021854

CALCULATED PROPERTIES

• Acid pKa: 4.54344
• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -1.2242727
• LogD (pH = 7.4): -2.9968748
• Log P: -0.22334571
• Molar Refractivity: 23.4808 cm^3
• Polarizability: 4.912116 Å^3
• Polar Surface Area: 40.13 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Crystalline Aggregates

Safety Information

• Storage Warning: Hygroscopic
• TSCA Listed: 是

Product Information

• Purity: 99.9%; 99.9% (REO)

DETAILS

MP Biomedicals - 05201931

MP Biomedicals Rare Chemical collection