spiro[4.5]decane

• ChemBase ID: 129600
• Molecular Formular: C10H18
• Molecular Mass: 138.24992
• Monoisotopic Mass: 138.14085058
• SMILES: C1CCC2(CCCCC2)C1
• Canonical SMILES: C1CCC2(CC1)CCCC2
• InChI: InChI=1S/C10H18/c1-2-6-10(7-3-1)8-4-5-9-10/h1-9H2
• InChIKey: CTDQAGUNKPRERK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: spiro[4.5]decane
• IUPAC Traditional name: spirodecane
• Synonyms: Spirodecane

Database IDs

• CAS Number: 176-63-6
• PubChem SID: 162223890
• PubChem CID: 135982
• Chemspider ID: 119760
• Wikipedia Title: Spirodecane

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 3.6798897
• LogD (pH = 7.4): 3.6798897
• Log P: 3.6798897
• Molar Refractivity: 44.0295 cm^3
• Polarizability: 17.72628 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true