palladium(2+) ion bis(triphenylphosphane) dibromide

• ChemBase ID: 302976
• Molecular Formular: C36H30Br2P2Pd
• Molecular Mass: 790.798922
• Monoisotopic Mass: 787.92243422
• SMILES: c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.[Br-].[Br-].[Pd+2]
• Canonical SMILES: c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.[Br-].[Br-].[Pd+2]
• InChI: InChI=1S/2C18H15P.2BrH.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;/h2*1-15H;2*1H;/q;;;;+2/p-2
• InChIKey: MCSDDEAMPOYJJI-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: palladium(2+) ion bis(triphenylphosphane) dibromide
• IUPAC Traditional name: palladium(2+) ion bis(triphenylphosphine) dibromide
• Synonyms: trans-Dibromobis(triphenylphosphine)palladium(II); 反式-二溴双(三苯基膦)钯(II)

Database IDs

• CAS Number: 22180-53-6
• MDL Number: MFCD00134175

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 5.1066
• LogD (pH = 7.4): 5.1066
• Log P: 5.1066
• Molar Refractivity: 81.6229 cm^3
• Polarizability: 32.34495 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Solubility: Soluble in chloroform, toluene and benzene
• Apperance: Powder

Safety Information

• Storage Warning: Hygroscopic
• TSCA Listed: 否

Product Information

• Purity: Pd 13.4%