5,10-dibromo-5,10-dichlorotricyclo[7.1.0.0^{4,6}]decane

• ChemBase ID: 85292
• Molecular Formular: C10H12Br2Cl2
• Molecular Mass: 362.91628
• Monoisotopic Mass: 359.86827974
• SMILES: BrC1(C2C1CCC1C(C1CC2)(Cl)Br)Cl
• Canonical SMILES: ClC1(Br)C2C1CCC1C(CC2)C1(Cl)Br
• InChI: InChI=1S/C10H12Br2Cl2/c11-9(13)5-1-2-6-8(10(6,12)14)4-3-7(5)9/h5-8H,1-4H2
• InChIKey: SFVAUXRMMFFMJV-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5,10-dibromo-5,10-dichlorotricyclo[7.1.0.0^{4,6}]decane
• IUPAC Traditional name: 5,10-dibromo-5,10-dichlorotricyclo[7.1.0.0^{4,6}]decane
• Synonyms: 5,10-dibromo-5,10-dichlorotricyclo[7.1.0.0~4,6~]decane

Database IDs

• MDL Number: MFCD01314316
• PubChem SID: 162072408
• PubChem CID: 2795276

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 4.197389
• LogD (pH = 7.4): 4.197389
• Log P: 4.197389
• Molar Refractivity: 68.166 cm^3
• Polarizability: 26.498901 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true