4-(4-methoxyphenyl)morpholine

• ChemBase ID: 795807
• Molecular Formular: C11H15NO2
• Molecular Mass: 193.2423
• Monoisotopic Mass: 193.11027873
• SMILES: C1COCCN1c1ccc(cc1)OC
• Canonical SMILES: COc1ccc(cc1)N1CCOCC1
• InChI: InChI=1S/C11H15NO2/c1-13-11-4-2-10(3-5-11)12-6-8-14-9-7-12/h2-5H,6-9H2,1H3
• InChIKey: FAAUAMNUAFGPAR-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-(4-methoxyphenyl)morpholine
• IUPAC Traditional name: 4-(4-methoxyphenyl)morpholine
• Synonyms: 4-(4-Methoxyphenyl)Morpholine

Database IDs

• CAS Number: 27347-14-4

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 1.7049831
• LogD (pH = 7.4): 1.7051163
• Log P: 1.705118
• Molar Refractivity: 56.0243 cm^3
• Polarizability: 21.311823 Å^3
• Polar Surface Area: 21.7 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%