2,7-dibromo-9,9-diphenyl-9H-fluorene

• ChemBase ID: 294160
• Molecular Formular: C25H16Br2
• Molecular Mass: 476.20254
• Monoisotopic Mass: 473.96187451
• SMILES: Brc1cc2c(cc1)c1c(cc(Br)cc1)C2(c1ccccc1)c1ccccc1
• Canonical SMILES: Brc1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1c2ccc(c1)Br
• InChI: InChI=1S/C25H16Br2/c26-19-11-13-21-22-14-12-20(27)16-24(22)25(23(21)15-19,17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-16H
• InChIKey: AJYDOCCGNIBJBY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,7-dibromo-9,9-diphenyl-9H-fluorene
• IUPAC Traditional name: 2,7-dibromo-9,9-diphenylfluorene
• Synonyms: 2,7-Dibromo-9,9-diphenyl-9H-fluorene

Database IDs

• CAS Number: 186259-63-2
• PubChem SID: 180679691
• PubChem CID: 16744636

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 8.131199
• LogD (pH = 7.4): 8.131199
• Log P: 8.131199
• Molar Refractivity: 119.3327 cm^3
• Polarizability: 46.78446 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: false

PROPERTIES

Product Information

• Purity: 95+%