[2-(2-methylphenyl)phenyl]diphenylphosphane

• ChemBase ID: 289324
• Molecular Formular: C25H21P
• Molecular Mass: 352.408001
• Monoisotopic Mass: 352.1380873
• SMILES: Cc1ccccc1c1ccccc1P(c1ccccc1)c1ccccc1
• Canonical SMILES: Cc1ccccc1c1ccccc1P(c1ccccc1)c1ccccc1
• InChI: InChI=1S/C25H21P/c1-20-12-8-9-17-23(20)24-18-10-11-19-25(24)26(21-13-4-2-5-14-21)22-15-6-3-7-16-22/h2-19H,1H3
• InChIKey: GUENDLLDUNRPIC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [2-(2-methylphenyl)phenyl]diphenylphosphane
• IUPAC Traditional name: [2-(2-methylphenyl)phenyl]diphenylphosphane
• Synonyms: (2'-Methyl-[1,1'-biphenyl]-2-yl)diphenylphosphine

Database IDs

• CAS Number: 402822-72-4
• MDL Number: MFCD19441232
• PubChem SID: 180674855
• PubChem CID: 15531745

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 7.2582
• LogD (pH = 7.4): 7.2582
• Log P: 7.2582
• Molar Refractivity: 111.8003 cm^3
• Polarizability: 45.203983 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: false

PROPERTIES

Product Information

• Purity: 95+%