[(diphenylphosphanyl)methyl]diphenylphosphane; bis(chlorogold)

• ChemBase ID: 135645
• Molecular Formular: C25H22Au2Cl2P2
• Molecular Mass: 849.228802
• Monoisotopic Mass: 847.99051532
• SMILES: c1ccc(cc1)P(CP(c1ccccc1)c1ccccc1)c1ccccc1.Cl[Au].Cl[Au]
• Canonical SMILES: c1ccc(cc1)P(c1ccccc1)CP(c1ccccc1)c1ccccc1.[Au]Cl.[Au]Cl
• InChI: InChI=1S/C25H22P2.2Au.2ClH/c1-5-13-22(14-6-1)26(23-15-7-2-8-16-23)21-27(24-17-9-3-10-18-24)25-19-11-4-12-20-25;;;;/h1-20H,21H2;;;2*1H/q;2*+1;;/p-2
• InChIKey: JNPUWTQJFLJEJC-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: [(diphenylphosphanyl)methyl]diphenylphosphane; bis(chlorogold)
• IUPAC Traditional name: [(diphenylphosphanyl)methyl]diphenylphosphane; bis(gold chloride)
• Synonyms: Methylenebis[diphenyl]phosphine gold complex; Bis(chlorogold(I)) bis(diphenylphosphino)methane; 双(氯金(I))双(二苯基膦)甲烷

Database IDs

• CAS Number: 37095-27-5
• MDL Number: MFCD08705280
• PubChem SID: 24884721; 162229918
• PubChem CID: 11700690

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 7.2909
• LogD (pH = 7.4): 7.2909
• Log P: 7.2909
• Molar Refractivity: 116.6195 cm^3
• Polarizability: 46.516495 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• German water hazard class: 3
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Product Information

• Purity: 97%
• Empirical Formula (Hill Notation): C25H22Au2Cl2P2

DETAILS

Sigma Aldrich - 665185

Packaging
1 g in glass bottle
250 mg in glass bottle
Application
Gold Catalysts - 21st Century ′Gold Rush′
Used for
• Pharmacological studies involving the anticancer activity of gold(I)-phosphine complexes as autophagy-inducing agents
• Triplet luminescent light emitting diodes with low turn-on voltageCatalyst for:
• Stereoselective preparation of vinyltetrahydrofuran via intramolecular hydroalkoxylation
• Hydroamination and hydroalkoxylation reactions
• Asymmetric transition metal catalysis
• Gold(I) catalyzed intramolecular Schmidt reactions of homopropargyl azides