tetrakis(dioxotitanium); bis(oxo[(oxoneodymio)oxy]neodymium)

• ChemBase ID: 145279
• Molecular Formular: Nd4O14Ti4
• Molecular Mass: 992.4196
• Monoisotopic Mass: 983.35148188
• SMILES: O=[Ti]=O.O=[Ti]=O.O=[Ti]=O.O=[Ti]=O.O=[Nd]O[Nd]=O.O=[Nd]O[Nd]=O
• Canonical SMILES: O=[Nd]O[Nd]=O.O=[Nd]O[Nd]=O.O=[Ti]=O.O=[Ti]=O.O=[Ti]=O.O=[Ti]=O
• InChI: InChI=1S/4Nd.14O.4Ti
• InChIKey: XXBVDTWSFRCPKR-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tetrakis(dioxotitanium); bis(oxo[(oxoneodymio)oxy]neodymium)
• IUPAC Traditional name: bis(oxo[(oxoneodymio)oxy]neodymium); tetrakis(titanium dioxide)
• Synonyms: Neodymium(III) titanate; 钛酸钕(III)

Database IDs

• MDL Number: MFCD00192342
• PubChem SID: 24865211; 162239487
• PubChem CID: 71311152

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -0.4316
• LogD (pH = 7.4): -0.4316
• Log P: -0.4316
• Molar Refractivity: 4.236 cm^3
• Polarizability: 14.776336 Å^3
• Polar Surface Area: 43.37 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Apperance: powder

Safety Information

• German water hazard class: 3

Product Information

• Particle Size: -325 mesh
• Linear Formula: 2Nd2O3 · 5TiO2

DETAILS

Sigma Aldrich - 403695

Packaging
500 g in poly bottle