1,1,1,5,5,5-hexafluoro-4-({[(1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-yl)oxy]palladio}oxy)pent-3-en-2-one

• ChemBase ID: 149469
• Molecular Formular: C10H2F12O4Pd
• Molecular Mass: 520.5213184
• Monoisotopic Mass: 519.87963318
• SMILES: C(=C(\O[Pd]O/C(=C/C(=O)C(F)(F)F)/C(F)(F)F)/C(F)(F)F)/C(=O)C(F)(F)F
• Canonical SMILES: O=C(C(F)(F)F)/C=C(\C(F)(F)F)/O[Pd]O/C(=C/C(=O)C(F)(F)F)/C(F)(F)F
• InChI: InChI=1S/2C5H2F6O2.Pd/c2*6-4(7,8)2(12)1-3(13)5(9,10)11;/h2*1,12H;/q;;+2/p-2
• InChIKey: OVIDFVVPPRGPGR-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: 1,1,1,5,5,5-hexafluoro-4-({[(1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-yl)oxy]palladio}oxy)pent-3-en-2-one
• IUPAC Traditional name: 1,1,1,5,5,5-hexafluoro-4-({[(1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-yl)oxy]palladio}oxy)pent-3-en-2-one
• Synonyms: Palladium(II) hexafluoroacetylacetonate; 六氟乙酰丙酮钯(II)

Database IDs

• CAS Number: 64916-48-9
• EC Number: 265-271-1
• MDL Number: MFCD00015709
• PubChem SID: 24865018; 162243634
• PubChem CID: 71311413

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): 4.1922
• LogD (pH = 7.4): 4.1922
• Log P: 4.1922
• Molar Refractivity: 58.2732 cm^3
• Polarizability: 25.259506 Å^3
• Polar Surface Area: 52.6 Å^2
• Rotatable Bonds: 10
• Lipinski's Rule of Five: false

PROPERTIES

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

• Linear Formula: Pd(C5HF6O2)2

DETAILS

Sigma Aldrich - 401471

Application
Used in a redox transmetalation reaction to enhance CVD alloying technology for copper. Also used in the simultaneous etching of copper and deposition of palladium for applications in ultra large-scale integrated devices.1
Packaging
1, 5 g in glass bottle