bis(4-methylphenyl)phosphane

• ChemBase ID: 294715
• Molecular Formular: C14H15P
• Molecular Mass: 214.242661
• Monoisotopic Mass: 214.09113711
• SMILES: Cc1ccc(Pc2ccc(C)cc2)cc1
• Canonical SMILES: Cc1ccc(cc1)Pc1ccc(cc1)C
• InChI: InChI=1S/C14H15P/c1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14/h3-10,15H,1-2H3
• InChIKey: RRSCGNXXNRAXJC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: bis(4-methylphenyl)phosphane
• IUPAC Traditional name: bis(4-methylphenyl)phosphane
• Synonyms: Di-p-tolylphosphine

Database IDs

• CAS Number: 1017-60-3
• MDL Number: MFCD01630843
• PubChem SID: 180680246
• PubChem CID: 4187661

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 4.1128
• LogD (pH = 7.4): 4.1128
• Log P: 4.1128
• Molar Refractivity: 67.031 cm^3
• Polarizability: 26.239805 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%