oxo[(oxoyttrio)oxy]yttrium; tris(oxobarium); trioxotungsten

• ChemBase ID: 138696
• Molecular Formular: Ba3O9WY2
• Molecular Mass: 917.6273
• Monoisotopic Mass: 919.43259958
• SMILES: O=[Y]O[Y]=O.O=[Ba].O=[Ba].O=[Ba].O=[W](=O)=O
• Canonical SMILES: O=[W](=O)=O.O=[Y]O[Y]=O.[Ba]=O.[Ba]=O.[Ba]=O
• InChI: InChI=1S/3Ba.9O.W.2Y
• InChIKey: KRVXLVSVAGUBBQ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: oxo[(oxoyttrio)oxy]yttrium; tris(oxobarium); trioxotungsten
• IUPAC Traditional name: tris(barium oxide); oxo[(oxoyttrio)oxy]yttrium; tungsten trioxide
• Synonyms: Barium yttrium tungsten oxide; 氧化钡钇钨

Database IDs

• CAS Number: 37265-86-4
• MDL Number: MFCD00213929
• PubChem SID: 162232947; 24865981
• PubChem CID: 71310169

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: 11.059541 Å^3
• Polar Surface Area: 43.37 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Apperance: powder

Safety Information

• European Hazard Symbols: Harmful (Xn)
• German water hazard class: 1
• Risk Statements: 20/22
• Safety Statements: 28
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H302-H332
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: 99.9%
• Particle Size: <5 μm
• Linear Formula: Ba3Y2WO9