1-(2-aminoethoxy)-2-phenylbenzene

• ChemBase ID: 306433
• Molecular Formular: C14H15NO
• Molecular Mass: 213.275
• Monoisotopic Mass: 213.11536411
• SMILES: c1(c(OCCN)cccc1)c1ccccc1
• Canonical SMILES: NCCOc1ccccc1c1ccccc1
• InChI: InChI=1S/C14H15NO/c15-10-11-16-14-9-5-4-8-13(14)12-6-2-1-3-7-12/h1-9H,10-11,15H2
• InChIKey: HQNCHQRPPCLSCC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-(2-aminoethoxy)-2-phenylbenzene
• IUPAC Traditional name: 1-(2-aminoethoxy)-2-phenylbenzene
• Synonyms: 2-(biphenyl-2-yloxy)ethanamine

Database IDs

• CAS Number: 23314-13-8
• MDL Number: MFCD00448366

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -0.29577953
• LogD (pH = 7.4): 0.80987024
• Log P: 2.665816
• Molar Refractivity: 65.6072 cm^3
• Polarizability: 27.293116 Å^3
• Polar Surface Area: 35.25 Å^2