7-azaspiro[4.5]decane

• ChemBase ID: 58213
• Molecular Formular: C9H17N
• Molecular Mass: 139.23798
• Monoisotopic Mass: 139.13609955
• SMILES: C1CCC2(CN1)CCCC2
• Canonical SMILES: C1CCC2(CN1)CCCC2
• InChI: InChI=1S/C9H17N/c1-2-5-9(4-1)6-3-7-10-8-9/h10H,1-8H2
• InChIKey: JFNPSSKPSOKMJH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 7-azaspiro[4.5]decane
• IUPAC Traditional name: 7-azaspiro[4.5]decane
• Synonyms: 7-Azaspiro[4.5]decane

Database IDs

• MDL Number: MFCD03175394
• PubChem SID: 162062976
• PubChem CID: 14448981

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -1.4065105
• LogD (pH = 7.4): -0.97198623
• Log P: 1.8258728
• Molar Refractivity: 43.1049 cm^3
• Polarizability: 17.397926 Å^3
• Polar Surface Area: 12.03 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false