1,1-dibromospiro[2.3]hexane

• ChemBase ID: 120461
• Molecular Formular: C6H8Br2
• Molecular Mass: 239.93572
• Monoisotopic Mass: 237.89927426
• SMILES: C1(C2(C1)CCC2)(Br)Br
• Canonical SMILES: BrC1(Br)CC21CCC2
• InChI: InChI=1S/C6H8Br2/c7-6(8)4-5(6)2-1-3-5/h1-4H2
• InChIKey: RBGBBKXQFGLLBJ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1,1-dibromospiro[2.3]hexane
• IUPAC Traditional name: 1,1-dibromospiro[2.3]hexane
• Synonyms: 1,1-dibromospiro[2.3]hexane

Database IDs

• PubChem SID: 162214814
• PubChem CID: 938916

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.4852872
• LogD (pH = 7.4): 2.4852872
• Log P: 2.4852872
• Molar Refractivity: 41.4271 cm^3
• Polarizability: 16.134302 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true