ethyl[2-(2-methoxyphenoxy)ethyl]amine

• ChemBase ID: 312303
• Molecular Formular: C11H17NO2
• Molecular Mass: 195.25818
• Monoisotopic Mass: 195.12592879
• SMILES: c1(c(OCCNCC)cccc1)OC
• Canonical SMILES: CCNCCOc1ccccc1OC
• InChI: InChI=1S/C11H17NO2/c1-3-12-8-9-14-11-7-5-4-6-10(11)13-2/h4-7,12H,3,8-9H2,1-2H3
• InChIKey: KVFTZNUFVREYKY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: ethyl[2-(2-methoxyphenoxy)ethyl]amine
• IUPAC Traditional name: ethyl[2-(2-methoxyphenoxy)ethyl]amine
• Synonyms: N-ethyl-2-(2-methoxyphenoxy)ethanamine

Database IDs

• CAS Number: 4766-09-0
• MDL Number: MFCD08691888

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -1.5301826
• LogD (pH = 7.4): -0.47749698
• Log P: 1.6503078
• Molar Refractivity: 56.4574 cm^3
• Polarizability: 22.417082 Å^3
• Polar Surface Area: 30.49 Å^2