ethyl(naphthalen-1-ylmethyl)amine

• ChemBase ID: 312477
• Molecular Formular: C13H15N
• Molecular Mass: 185.2649
• Monoisotopic Mass: 185.12044949
• SMILES: c12c(CNCC)cccc1cccc2
• Canonical SMILES: CCNCc1cccc2c1cccc2
• InChI: InChI=1S/C13H15N/c1-2-14-10-12-8-5-7-11-6-3-4-9-13(11)12/h3-9,14H,2,10H2,1H3
• InChIKey: JFVQSRKXAAXZIK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: ethyl(naphthalen-1-ylmethyl)amine
• IUPAC Traditional name: ethyl(naphthalen-1-ylmethyl)amine
• Synonyms: N-(1-naphthylmethyl)ethanamine

Database IDs

• CAS Number: 14489-76-0
• MDL Number: MFCD04559485

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -0.34336552
• LogD (pH = 7.4): 0.3246222
• Log P: 2.8778794
• Molar Refractivity: 60.5048 cm^3
• Polarizability: 25.086649 Å^3
• Polar Surface Area: 12.03 Å^2