2-(4-methoxyphenyl)morpholine

• ChemBase ID: 76279
• Molecular Formular: C11H15NO2
• Molecular Mass: 193.2423
• Monoisotopic Mass: 193.11027873
• SMILES: N1CC(c2ccc(cc2)OC)OCC1
• Canonical SMILES: COc1ccc(cc1)C1OCCNC1
• InChI: InChI=1S/C11H15NO2/c1-13-10-4-2-9(3-5-10)11-8-12-6-7-14-11/h2-5,11-12H,6-8H2,1H3
• InChIKey: PLULTGXHWIAVIR-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(4-methoxyphenyl)morpholine
• IUPAC Traditional name: 2-(4-methoxyphenyl)morpholine
• Synonyms: 4-(Morpholin-2-yl)anisole; 2-(4-Methoxyphenyl)morpholine

Database IDs

• CAS Number: 83555-74-2
• MDL Number: MFCD03840011
• PubChem SID: 162041186
• PubChem CID: 3759546

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -1.3167868
• LogD (pH = 7.4): 0.41665605
• Log P: 1.21519
• Molar Refractivity: 54.5139 cm^3
• Polarizability: 21.69396 Å^3
• Polar Surface Area: 30.49 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: Corrosive/Harmful/Air Sensitive/Store under Argon

Product Information

• Purity: 98%