(2-methylphenyl)(phenyl)methanamine

• ChemBase ID: 308822
• Molecular Formular: C14H15N
• Molecular Mass: 197.2756
• Monoisotopic Mass: 197.12044949
• SMILES: c1(C(c2ccccc2)N)c(C)cccc1
• Canonical SMILES: Cc1ccccc1C(c1ccccc1)N
• InChI: InChI=1S/C14H15N/c1-11-7-5-6-10-13(11)14(15)12-8-3-2-4-9-12/h2-10,14H,15H2,1H3
• InChIKey: LZLNARHIRUKNFV-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2-methylphenyl)(phenyl)methanamine
• IUPAC Traditional name: (2-methylphenyl)(phenyl)methanamine
• Synonyms: 1-(2-methylphenyl)-1-phenylmethanamine

Database IDs

• CAS Number: 2936-62-1
• MDL Number: MFCD00185145

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): 0.47547677
• LogD (pH = 7.4): 1.7412403
• Log P: 3.3966758
• Molar Refractivity: 63.8554 cm^3
• Polarizability: 25.157381 Å^3
• Polar Surface Area: 26.02 Å^2