bicyclo[2.1.0]pentane

• ChemBase ID: 127726
• Molecular Formular: C5H8
• Molecular Mass: 68.11702
• Monoisotopic Mass: 68.06260026
• SMILES: C1C2CCC12
• Canonical SMILES: C1CC2C1C2
• InChI: InChI=1S/C5H8/c1-2-5-3-4(1)5/h4-5H,1-3H2
• InChIKey: MHLPKAGDPWUOOT-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: bicyclo[2.1.0]pentane
• IUPAC Traditional name: bicyclo[2.1.0]pentane
• Synonyms: Housane

Database IDs

• CAS Number: 185-94-4
• PubChem SID: 162222044
• PubChem CID: 9101
• Chemspider ID: 8747
• Wikipedia Title: Housane

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.4440182
• LogD (pH = 7.4): 1.4440182
• Log P: 1.4440182
• Molar Refractivity: 21.098 cm^3
• Polarizability: 8.492245 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true