(propanoyloxy)palladio propanoate

• ChemBase ID: 148855
• Molecular Formular: C6H10O4Pd
• Molecular Mass: 252.5612
• Monoisotopic Mass: 251.9613948
• SMILES: CCC(=O)O[Pd]OC(=O)CC
• Canonical SMILES: CCC(=O)O[Pd]OC(=O)CC
• InChI: InChI=1S/2C3H6O2.Pd/c2*1-2-3(4)5;/h2*2H2,1H3,(H,4,5);/q;;+2/p-2
• InChIKey: ZVSLRJWQDNRUDU-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: (propanoyloxy)palladio propanoate
• IUPAC Traditional name: (propanoyloxy)palladio propanoate
• Synonyms: Palladium(II) propionate; 钯(II)丙酸盐

Database IDs

• CAS Number: 3386-65-0
• MDL Number: MFCD00792325
• PubChem SID: 162243028; 24871743
• PubChem CID: 71311366

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 1.143
• LogD (pH = 7.4): 1.143
• Log P: 1.143
• Molar Refractivity: 32.686 cm^3
• Polarizability: 18.218248 Å^3
• Polar Surface Area: 52.6 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 154-156 °C(lit.)

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26-36
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: ≥99.9% trace metals basis
• Linear Formula: (C2H5CO2)2Pd

DETAILS

Sigma Aldrich - 481165

Packaging
1, 5 g in glass bottle