1-azaspiro[3.5]nonane hydrochloride

• ChemBase ID: 283138
• Molecular Formular: C8H16ClN
• Molecular Mass: 161.67234
• Monoisotopic Mass: 161.0971272
• SMILES: N1C2(CC1)CCCCC2.Cl
• Canonical SMILES: C1CCC2(CC1)CCN2.Cl
• InChI: InChI=1S/C8H15N.ClH/c1-2-4-8(5-3-1)6-7-9-8;/h9H,1-7H2;1H
• InChIKey: GPWATQMKTRHHTG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-azaspiro[3.5]nonane hydrochloride
• IUPAC Traditional name: 1-azaspiro[3.5]nonane hydrochloride
• Synonyms: 1-azaspiro[3.5]nonane hydrochloride

Database IDs

• MDL Number: MFCD20441749
• PubChem SID: 180668669
• PubChem CID: 54595633

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -1.8211296
• LogD (pH = 7.4): -1.6708256
• Log P: 1.4185956
• Molar Refractivity: 38.4936 cm^3
• Polarizability: 15.551486 Å^3
• Polar Surface Area: 12.03 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.808

Product Information

• Purity: 95%