palladium(2+) ion bis(triethylphosphane) dichloride

• ChemBase ID: 303470
• Molecular Formular: C12H30Cl2P2Pd
• Molecular Mass: 413.640122
• Monoisotopic Mass: 412.02346558
• SMILES: CCP(CC)CC.CCP(CC)CC.[Cl-].[Cl-].[Pd+2]
• Canonical SMILES: CCP(CC)CC.CCP(CC)CC.[Cl-].[Cl-].[Pd+2]
• InChI: InChI=1S/2C6H15P.2ClH.Pd/c2*1-4-7(5-2)6-3;;;/h2*4-6H2,1-3H3;2*1H;/q;;;;+2/p-2
• InChIKey: ULYNIEUXPCUIEL-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: palladium(2+) ion bis(triethylphosphane) dichloride
• IUPAC Traditional name: palladium(2+) ion bis(triethylphosphine) dichloride
• Synonyms: trans-Dichlorobis(triethylphosphine)palladium(II); 反式双(三乙基膦)二氯化钯(II)

Database IDs

• CAS Number: 28425-04-9
• MDL Number: MFCD00191831

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 0.91666883
• LogD (pH = 7.4): 0.979991
• Log P: 1.7648
• Molar Refractivity: 41.0508 cm^3
• Polarizability: 14.511799 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Soluble in chloroform, toluene and benzene

Safety Information

• Storage Warning: Hygroscopic
• European Hazard Symbols: Toxic (T)
• UN Number: UN3464
• Hazard Class: 6.1
• Packing Group: III
• Risk Statements: 20-24/25-36
• Safety Statements: 4-9-20-26-27-36/37/39-45-60
• TSCA Listed: 否
• GHS Pictograms: GHS06
• GHS Hazard statements: H301-H311-H331-H319
• GHS Precautionary statements: P261-P301+P310-P305+P351+P338-P361-P405-P501A