barium(2+) ion palladium(2+) ion dicarbonate

• ChemBase ID: 145451
• Molecular Formular: C2BaO6Pd
• Molecular Mass: 363.7648
• Monoisotopic Mass: 363.77822072
• SMILES: C(=O)([O-])[O-].C(=O)([O-])[O-].[Pd+2].[Ba+2]
• Canonical SMILES: [O-]C(=O)[O-].[O-]C(=O)[O-].[Pd+2].[Ba+2]
• InChI: InChI=1S/2CH2O3.Ba.Pd/c2*2-1(3)4;;/h2*(H2,2,3,4);;/q;;2*+2/p-4
• InChIKey: NFXIBAPFNPIUGD-UHFFFAOYSA-J

NAMES AND DATABASE IDS

Names

• IUPAC name: barium(2+) ion palladium(2+) ion dicarbonate
• IUPAC Traditional name: barium(2+) ion palladium(2+) ion dicarbonate
• Synonyms: Palladium on barium carbonate; 碳酸钡负载钯

Database IDs

• MDL Number: MFCD03427451
• PubChem SID: 162239657; 24854250
• PubChem CID: 16211661

CALCULATED PROPERTIES

• Acid pKa: 6.0525417
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 0.142811
• LogD (pH = 7.4): -1.1138874
• Log P: 0.25005138
• Molar Refractivity: 31.1724 cm^3
• Polarizability: 3.6386902 Å^3
• Polar Surface Area: 63.19 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• European Hazard Symbols: Harmful (Xn)
• German water hazard class: nwg
• Risk Statements: 22
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H302
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Faceshields, Gloves

Product Information

• Extent of Labeling: 5 wt. % loading
• Linear Formula: Pd

DETAILS

Sigma Aldrich - 237523

Packaging
10 g in glass bottle