benzyl[(4-phenylphenyl)methyl]amine

• ChemBase ID: 311652
• Molecular Formular: C20H19N
• Molecular Mass: 273.37156
• Monoisotopic Mass: 273.15174961
• SMILES: c1(c2ccccc2)ccc(cc1)CNCc1ccccc1
• Canonical SMILES: c1ccc(cc1)CNCc1ccc(cc1)c1ccccc1
• InChI: InChI=1S/C20H19N/c1-3-7-17(8-4-1)15-21-16-18-11-13-20(14-12-18)19-9-5-2-6-10-19/h1-14,21H,15-16H2
• InChIKey: RSTFPRQYGUIJDX-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: benzyl[(4-phenylphenyl)methyl]amine
• IUPAC Traditional name: benzyl[(4-phenylphenyl)methyl]amine
• Synonyms: N-benzyl-1-biphenyl-4-ylmethanamine

Database IDs

• CAS Number: 294885-81-7
• MDL Number: MFCD03210599

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): 1.831087
• LogD (pH = 7.4): 3.2434118
• Log P: 4.903293
• Molar Refractivity: 89.0548 cm^3
• Polarizability: 36.3522 Å^3
• Polar Surface Area: 12.03 Å^2