(2R)-1-(morpholin-4-yl)propan-2-ol

• ChemBase ID: 247129
• Molecular Formular: C7H15NO2
• Molecular Mass: 145.1995
• Monoisotopic Mass: 145.11027873
• SMILES: N1(C[C@H](O)C)CCOCC1
• Canonical SMILES: C[C@H](CN1CCOCC1)O
• InChI: InChI=1S/C7H15NO2/c1-7(9)6-8-2-4-10-5-3-8/h7,9H,2-6H2,1H3/t7-/m1/s1
• InChIKey: YAXQOLYGKLGQKA-SSDOTTSWSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2R)-1-(morpholin-4-yl)propan-2-ol
• IUPAC Traditional name: (2R)-1-(morpholin-4-yl)propan-2-ol
• Synonyms: (2R)-1-(morpholin-4-yl)propan-2-ol

Database IDs

• PubChem SID: 164303039
• PubChem CID: 6950694

CALCULATED PROPERTIES

• Acid pKa: 15.287387
• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -2.2385662
• LogD (pH = 7.4): -0.62511086
• Log P: -0.30185798
• Molar Refractivity: 39.7737 cm^3
• Polarizability: 15.740703 Å^3
• Polar Surface Area: 32.7 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): -0.099

Product Information

• Purity: 95%