2-(morpholin-4-ylmethyl)phenol

• ChemBase ID: 307732
• Molecular Formular: C11H15NO2
• Molecular Mass: 193.2423
• Monoisotopic Mass: 193.11027873
• SMILES: c1(CN2CCOCC2)c(O)cccc1
• Canonical SMILES: Oc1ccccc1CN1CCOCC1
• InChI: InChI=1S/C11H15NO2/c13-11-4-2-1-3-10(11)9-12-5-7-14-8-6-12/h1-4,13H,5-9H2
• InChIKey: OYLIEVIKIUHKTG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(morpholin-4-ylmethyl)phenol
• IUPAC Traditional name: 2-(morpholin-4-ylmethyl)phenol
• Synonyms: 2-(morpholin-4-ylmethyl)phenol

Database IDs

• CAS Number: 4438-01-1
• MDL Number: MFCD00963423

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -0.62711763
• LogD (pH = 7.4): 0.9871744
• Log P: 1.1692823
• Molar Refractivity: 55.6561 cm^3
• Polarizability: 21.624495 Å^3
• Polar Surface Area: 32.7 Å^2