8-azaspiro[4.5]decane hydrochloride

• ChemBase ID: 796499
• Molecular Formular: C9H18ClN
• Molecular Mass: 175.69892
• Monoisotopic Mass: 175.11277726
• SMILES: Cl.C1CCCC21CCNCC2
• Canonical SMILES: N1CCC2(CC1)CCCC2.Cl
• InChI: InChI=1S/C9H17N.ClH/c1-2-4-9(3-1)5-7-10-8-6-9;/h10H,1-8H2;1H
• InChIKey: DRTLAKIFUNGWIM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 8-azaspiro[4.5]decane hydrochloride
• IUPAC Traditional name: azaspirodecane hydrochloride
• Synonyms: 8-Azaspiro[4.5]decane hydrochloride

Database IDs

• CAS Number: 1123-30-4

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -1.5609816
• LogD (pH = 7.4): -1.087869
• Log P: 1.6699653
• Molar Refractivity: 43.2589 cm^3
• Polarizability: 17.397926 Å^3
• Polar Surface Area: 12.03 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 97%