1-oxa-8-azaspiro[4.5]decan-3-ol

• ChemBase ID: 309909
• Molecular Formular: C8H15NO2
• Molecular Mass: 157.2102
• Monoisotopic Mass: 157.11027873
• SMILES: C12(OCC(C1)O)CCNCC2
• Canonical SMILES: OC1COC2(C1)CCNCC2
• InChI: InChI=1S/C8H15NO2/c10-7-5-8(11-6-7)1-3-9-4-2-8/h7,9-10H,1-6H2
• InChIKey: JQNSUWHWLBLHQL-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-oxa-8-azaspiro[4.5]decan-3-ol
• IUPAC Traditional name: 1-oxa-8-azaspiro[4.5]decan-3-ol
• Synonyms: 1-oxa-8-azaspiro[4.5]decan-3-ol

Database IDs

• CAS Number: 757239-76-2
• MDL Number: MFCD18073388

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -4.2690763
• LogD (pH = 7.4): -3.570425
• Log P: -1.0498238
• Molar Refractivity: 41.9174 cm^3
• Polarizability: 16.856157 Å^3
• Polar Surface Area: 41.49 Å^2