9,9-dichloro-9H-fluorene

• ChemBase ID: 287033
• Molecular Formular: C13H8Cl2
• Molecular Mass: 235.10862
• Monoisotopic Mass: 234.00030562
• SMILES: ClC1(Cl)c2c(c3c1cccc3)cccc2
• Canonical SMILES: ClC1(Cl)c2ccccc2c2c1cccc2
• InChI: InChI=1S/C13H8Cl2/c14-13(15)11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8H
• InChIKey: LSTBDYVWQHHYHU-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 9,9-dichloro-9H-fluorene
• IUPAC Traditional name: 9,9-dichlorofluorene
• Synonyms: 9,9-Dichloro-9H-fluorene

Database IDs

• CAS Number: 25023-01-2
• PubChem SID: 180672564
• PubChem CID: 90689

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 4.861948
• LogD (pH = 7.4): 4.861948
• Log P: 4.861948
• Molar Refractivity: 64.7774 cm^3
• Polarizability: 26.03123 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%; 97%