4-fluorofluoren-9-one

C13H7FO — CID 15193

IUPAC4-fluorofluoren-9-one
SMILESO=C1c2ccccc2-c2c(F)cccc21
InChIInChI=1S/C13H7FO/c14-11-7-3-6-10-12(11)8-4-1-2-5-9(8)13(10)15/h1-7H
InChIKeyCBJABQXTFIBKGZ-UHFFFAOYSA-N
MW198.20 g/mol
LogP3.04
Rot. Bonds

About 4-fluorofluoren-9-one

4-fluorofluoren-9-one (PubChem CID 15193) has the molecular formula C13H7FO and a molecular weight of 198.20 g/mol. Its IUPAC name is 4-fluorofluoren-9-one.

Molecular Properties

Compound Name4-fluorofluoren-9-one
PubChem CID15193
Molecular FormulaC13H7FO
Molecular Weight198.20 g/mol
Exact Mass198.05
IUPAC Name4-fluorofluoren-9-one
SMILESO=C1c2ccccc2-c2c(F)cccc21
InChIInChI=1S/C13H7FO/c14-11-7-3-6-10-12(11)8-4-1-2-5-9(8)13(10)15/h1-7H
InChIKeyCBJABQXTFIBKGZ-UHFFFAOYSA-N
XLogP3.04
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.20
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-fluorofluoren-9-one?
The IUPAC name of 4-fluorofluoren-9-one (CID 15193) is 4-fluorofluoren-9-one.
What is the SMILES notation for 4-fluorofluoren-9-one?
The canonical SMILES for 4-fluorofluoren-9-one is O=C1c2ccccc2-c2c(F)cccc21.
What is the InChIKey of 4-fluorofluoren-9-one?
The InChIKey is CBJABQXTFIBKGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7FO/c14-11-7-3-6-10-12(11)8-4-1-2-5-9(8)13(10)15/h1-7H.
What are the key properties of 4-fluorofluoren-9-one?
4-fluorofluoren-9-one has a molecular weight of 198.20 g/mol, XLogP of 3.04, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluorofluoren-9-one is sourced from PubChem (CID 15193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).