2-(morpholin-2-yl)ethan-1-ol

• ChemBase ID: 307664
• Molecular Formular: C6H13NO2
• Molecular Mass: 131.17292
• Monoisotopic Mass: 131.09462866
• SMILES: N1CC(OCC1)CCO
• Canonical SMILES: OCCC1CNCCO1
• InChI: InChI=1S/C6H13NO2/c8-3-1-6-5-7-2-4-9-6/h6-8H,1-5H2
• InChIKey: OJZYVZNGKDTSFP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(morpholin-2-yl)ethan-1-ol
• IUPAC Traditional name: 2-(morpholin-2-yl)ethanol
• Synonyms: 2-morpholin-2-ylethanol

Database IDs

• CAS Number: 132995-76-7
• MDL Number: MFCD09608099

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -3.6585772
• LogD (pH = 7.4): -1.9435511
• Log P: -0.9817541
• Molar Refractivity: 34.5958 cm^3
• Polarizability: 13.90578 Å^3
• Polar Surface Area: 41.49 Å^2