octafluorobiphenylene

• ChemBase ID: 96853
• Molecular Formular: C12F8
• Molecular Mass: 296.1156256
• Monoisotopic Mass: 295.98722576
• SMILES: Fc1c2c(c(c(c1F)F)F)c1c2c(c(c(c1F)F)F)F
• Canonical SMILES: Fc1c2c(c3c2c(F)c(c(c3F)F)F)c(c(c1F)F)F
• InChI: InChI=1S/C12F8/c13-5-1-2(6(14)10(18)9(5)17)4-3(1)7(15)11(19)12(20)8(4)16
• InChIKey: CQKQSUKECBDFHR-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: octafluorobiphenylene
• IUPAC Traditional name: octafluorobiphenylene
• Synonyms: Octafluorobiphenylene

Database IDs

• MDL Number: MFCD01631689
• PubChem SID: 162083497
• PubChem CID: 2775845

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 4.436066
• LogD (pH = 7.4): 4.436066
• Log P: 4.436066
• Molar Refractivity: 52.0036 cm^3
• Polarizability: 20.055191 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: Irritant