2-cyclopentylcyclopentan-1-ol

• ChemBase ID: 112860
• Molecular Formular: C10H18O
• Molecular Mass: 154.24932
• Monoisotopic Mass: 154.1357652
• SMILES: OC1CCCC1C1CCCC1
• Canonical SMILES: OC1CCCC1C1CCCC1
• InChI: InChI=1S/C10H18O/c11-10-7-3-6-9(10)8-4-1-2-5-8/h8-11H,1-7H2
• InChIKey: QMWSCHMOUMCING-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-cyclopentylcyclopentan-1-ol
• IUPAC Traditional name: 1,1'-bicyclopentyl -2-ol
• Synonyms: 2-CYCLOPENTYL CYCLOPENTANOL

Database IDs

• PubChem SID: 162106889
• PubChem CID: 107348

CALCULATED PROPERTIES

• Acid pKa: 18.84054
• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): 2.3580968
• LogD (pH = 7.4): 2.3580968
• Log P: 2.3580968
• Molar Refractivity: 45.6955 cm^3
• Polarizability: 18.31186 Å^3
• Polar Surface Area: 20.23 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

DETAILS

MP Biomedicals - 05226243

MP Biomedicals Rare Chemical collection