(3-methylphenyl)(phenyl)methanamine

• ChemBase ID: 308786
• Molecular Formular: C14H15N
• Molecular Mass: 197.2756
• Monoisotopic Mass: 197.12044949
• SMILES: c1(C(c2ccccc2)N)cc(ccc1)C
• Canonical SMILES: Cc1cccc(c1)C(c1ccccc1)N
• InChI: InChI=1S/C14H15N/c1-11-6-5-9-13(10-11)14(15)12-7-3-2-4-8-12/h2-10,14H,15H2,1H3
• InChIKey: OLWWNHQOJUELFD-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (3-methylphenyl)(phenyl)methanamine
• IUPAC Traditional name: (3-methylphenyl)(phenyl)methanamine
• Synonyms: 1-(3-methylphenyl)-1-phenylmethanamine

Database IDs

• CAS Number: 55095-20-0
• MDL Number: MFCD09815829

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): 0.46939644
• LogD (pH = 7.4): 1.7155304
• Log P: 3.3966758
• Molar Refractivity: 63.8554 cm^3
• Polarizability: 25.157093 Å^3
• Polar Surface Area: 26.02 Å^2