(cyclohexylmethyl)(1-phenylethyl)amine

• ChemBase ID: 311658
• Molecular Formular: C15H23N
• Molecular Mass: 217.34982
• Monoisotopic Mass: 217.18304974
• SMILES: N(C(c1ccccc1)C)CC1CCCCC1
• Canonical SMILES: CC(c1ccccc1)NCC1CCCCC1
• InChI: InChI=1S/C15H23N/c1-13(15-10-6-3-7-11-15)16-12-14-8-4-2-5-9-14/h3,6-7,10-11,13-14,16H,2,4-5,8-9,12H2,1H3
• InChIKey: UHABCGJJMSQRRP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (cyclohexylmethyl)(1-phenylethyl)amine
• IUPAC Traditional name: (cyclohexylmethyl)(1-phenylethyl)amine
• Synonyms: (cyclohexylmethyl)(1-phenylethyl)amine

Database IDs

• CAS Number: 356540-15-3
• MDL Number: MFCD03211371

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): 0.8354868
• LogD (pH = 7.4): 1.3999283
• Log P: 4.062453
• Molar Refractivity: 69.4698 cm^3
• Polarizability: 27.778837 Å^3
• Polar Surface Area: 12.03 Å^2