tetrakis(propan-2-yloxy)cerium

• ChemBase ID: 303789
• Molecular Formular: C12H28CeO4
• Molecular Mass: 376.46432
• Monoisotopic Mass: 376.10419738
• SMILES: CC(C)O[Ce](OC(C)C)(OC(C)C)OC(C)C
• Canonical SMILES: CC(O[Ce](OC(C)C)(OC(C)C)OC(C)C)C
• InChI: InChI=1S/4C3H7O.Ce/c4*1-3(2)4;/h4*3H,1-2H3;/q4*-1;+4
• InChIKey: BCBBBOXRROHVFG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tetrakis(propan-2-yloxy)cerium
• IUPAC Traditional name: tetraisopropoxycerium
• Synonyms: Cerium(IV) isopropoxide; 异丙醇铈(IV)

Database IDs

• CAS Number: 63007-83-0
• MDL Number: MFCD00061483

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): 3.7892
• LogD (pH = 7.4): 3.7892
• Log P: 3.7892
• Molar Refractivity: 64.8572 cm^3
• Polarizability: 31.779137 Å^3
• Polar Surface Area: 36.92 Å^2
• Rotatable Bonds: 8
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Soluble in pyridine
• Apperance: Powder
• Melting Point: 140°C dec.

Safety Information

• Storage Warning: Air & 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-H228
• GHS Precautionary statements: P280-P303+P361+P353-P305+P351+P338-P310

Product Information

• Purity: Ce 37-45%