2-(methoxymethyl)morpholine

• ChemBase ID: 279284
• Molecular Formular: C6H13NO2
• Molecular Mass: 131.17292
• Monoisotopic Mass: 131.09462866
• SMILES: N1CC(OCC1)COC
• Canonical SMILES: COCC1CNCCO1
• InChI: InChI=1S/C6H13NO2/c1-8-5-6-4-7-2-3-9-6/h6-7H,2-5H2,1H3
• InChIKey: ZPELJYYPPKJKBE-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(methoxymethyl)morpholine
• IUPAC Traditional name: 2-(methoxymethyl)morpholine
• Synonyms: 2-(methoxymethyl)morpholine

Database IDs

• MDL Number: MFCD13187946
• PubChem SID: 164335194
• PubChem CID: 14933202

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -3.1331248
• LogD (pH = 7.4): -1.4333522
• Log P: -0.39858738
• Molar Refractivity: 34.4816 cm^3
• Polarizability: 13.976185 Å^3
• Polar Surface Area: 30.49 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): -0.339

Product Information

• Purity: 95%