lanthanum(3+) ion triethanolate

• ChemBase ID: 303197
• Molecular Formular: C6H15LaO3
• Molecular Mass: 274.087
• Monoisotopic Mass: 274.00847234
• SMILES: CC[O-].CC[O-].CC[O-].[La+3]
• Canonical SMILES: [O-]CC.[O-]CC.[O-]CC.[La+3]
• InChI: InChI=1S/3C2H5O.La/c3*1-2-3;/h3*2H2,1H3;/q3*-1;+3
• InChIKey: NPAJGHOZGYPSTK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: lanthanum(3+) ion triethanolate
• IUPAC Traditional name: lanthanum(3+) ion tris(ethoxide)
• Synonyms: Lanthanum(III) ethoxide; 乙氧基镧(III)

Database IDs

• CAS Number: 90397-54-9
• MDL Number: MFCD00075070

CALCULATED PROPERTIES

• Acid pKa: 16.470615
• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): -0.1617691
• LogD (pH = 7.4): -0.1617691
• Log P: -0.1617691
• Molar Refractivity: 23.5602 cm^3
• Polarizability: 4.748913 Å^3
• Polar Surface Area: 23.06 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Crystalline

Safety Information

• Storage Warning: Moisture Sensitive
• European Hazard Symbols: Corrosive (C); Flammable (F)
• UN Number: UN2925
• Hazard Class: 4.1
• Packing Group: III
• Risk Statements: 11-34
• Safety Statements: 16-26-36/37/39-45
• TSCA Listed: 否
• GHS Pictograms: GHS02; GHS05
• GHS Hazard statements: H314-H318-H228
• GHS Precautionary statements: P210-P280-P303+P361+P353-P305+P351+P338-P310

Product Information

• Purity: 95% (REO)