4-(cyclohexyloxy)piperidine hydrochloride

• ChemBase ID: 266306
• Molecular Formular: C11H22ClNO
• Molecular Mass: 219.75148
• Monoisotopic Mass: 219.13899201
• SMILES: N1CCC(OC2CCCCC2)CC1.Cl
• Canonical SMILES: C1CCC(CC1)OC1CCNCC1.Cl
• InChI: InChI=1S/C11H21NO.ClH/c1-2-4-10(5-3-1)13-11-6-8-12-9-7-11;/h10-12H,1-9H2;1H
• InChIKey: RJZZGSJPMWSOAN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-(cyclohexyloxy)piperidine hydrochloride
• IUPAC Traditional name: 4-(cyclohexyloxy)piperidine hydrochloride
• Synonyms: 4-(cyclohexyloxy)piperidine hydrochloride

Database IDs

• MDL Number: MFCD15209647
• PubChem SID: 164322216
• PubChem CID: 47002664

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -1.6523558
• LogD (pH = 7.4): -0.96393406
• Log P: 1.5675782
• Molar Refractivity: 54.1831 cm^3
• Polarizability: 21.75466 Å^3
• Polar Surface Area: 21.26 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 246 - 248°C
• Hydrophobicity(logP): 1.455

Product Information

• Purity: 95%