[2-(diphenylphosphanyl)ethyl]diphenylphosphane; bis(chlorogold)

• ChemBase ID: 142751
• Molecular Formular: C26H24Au2Cl2P2
• Molecular Mass: 863.255382
• Monoisotopic Mass: 862.00616539
• SMILES: c1ccc(cc1)P(CCP(c1ccccc1)c1ccccc1)c1ccccc1.Cl[Au].Cl[Au]
• Canonical SMILES: c1ccc(cc1)P(c1ccccc1)CCP(c1ccccc1)c1ccccc1.[Au]Cl.[Au]Cl
• InChI: InChI=1S/C26H24P2.2Au.2ClH/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;;;;/h1-20H,21-22H2;;;2*1H/q;2*+1;;/p-2
• InChIKey: VYRCUTQUNKAXBM-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: [2-(diphenylphosphanyl)ethyl]diphenylphosphane; bis(chlorogold)
• IUPAC Traditional name: diphos; bis(gold chloride)
• Synonyms: 1,2-Ethanediylbis[diphenyl]phosphine gold complex; [1,2-Bis(diphenylphosphino)ethane]dichlorodigold(I); Dichloro(DPPE)digold(I); [1,2-双(二苯基膦)乙烷]二氯二金(I); 二氯(DPPE)二金(I)

Database IDs

• CAS Number: 18024-34-5
• MDL Number: MFCD15144867
• PubChem SID: 162236977
• PubChem CID: 12624729

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 6.8128
• LogD (pH = 7.4): 6.8128
• Log P: 6.8128
• Molar Refractivity: 121.8328 cm^3
• Polarizability: 48.36459 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 7
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Melting Point: 286-289 °C

Safety Information

• German water hazard class: 3

Product Information

• Purity: 96%
• Empirical Formula (Hill Notation): C26H24Au2Cl2P2

DETAILS

Sigma Aldrich - 717363

Packaging
250 mg in glass bottle
Application
Gold Catalysts - 21st Century ′Gold Rush′
Catalyst for selective diboration of alkenes via base-assisted heterolytic cleavage