9,9-dimethyl-9H-fluorene

• ChemBase ID: 287035
• Molecular Formular: C15H14
• Molecular Mass: 194.27166
• Monoisotopic Mass: 194.10955045
• SMILES: CC1(C)c2c(c3c1cccc3)cccc2
• Canonical SMILES: CC1(C)c2ccccc2c2c1cccc2
• InChI: InChI=1S/C15H14/c1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)15/h3-10H,1-2H3
• InChIKey: ZHQNDEHZACHHTA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 9,9-dimethyl-9H-fluorene
• IUPAC Traditional name: 9,9-dimethylfluorene
• Synonyms: 9,9-Dimethyl-9H-fluorene

Database IDs

• CAS Number: 4569-45-3
• PubChem SID: 180672566
• PubChem CID: 78325

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 4.3260856
• LogD (pH = 7.4): 4.3260856
• Log P: 4.3260856
• Molar Refractivity: 74.3915 cm^3
• Polarizability: 26.213585 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%; 97%