3-(furan-2-yl)morpholine

• ChemBase ID: 273238
• Molecular Formular: C8H11NO2
• Molecular Mass: 153.17844
• Monoisotopic Mass: 153.0789786
• SMILES: c1(C2NCCOC2)occc1
• Canonical SMILES: C1CNC(CO1)c1ccco1
• InChI: InChI=1S/C8H11NO2/c1-2-8(11-4-1)7-6-10-5-3-9-7/h1-2,4,7,9H,3,5-6H2
• InChIKey: ZWKYZQSUEWJTLX-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 3-(furan-2-yl)morpholine
• IUPAC Traditional name: 3-(furan-2-yl)morpholine
• Synonyms: 3-(furan-2-yl)morpholine

Database IDs

• MDL Number: MFCD09901522
• PubChem SID: 164329148
• PubChem CID: 24271584

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -0.6962405
• LogD (pH = 7.4): 0.36936334
• Log P: 0.4331079
• Molar Refractivity: 40.4416 cm^3
• Polarizability: 16.053951 Å^3
• Polar Surface Area: 34.4 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.326

Product Information

• Purity: 95%