fluoren-9-one

C13H8O — CID 10241

IUPACfluoren-9-one
SMILESO=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C13H8O/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8H
InChIKeyYLQWCDOCJODRMT-UHFFFAOYSA-N
MW180.21 g/mol
LogP2.90
Rot. Bonds

About fluoren-9-one

fluoren-9-one (PubChem CID 10241) has the molecular formula C13H8O and a molecular weight of 180.21 g/mol. Its IUPAC name is fluoren-9-one.

Molecular Properties

Compound Namefluoren-9-one
PubChem CID10241
Molecular FormulaC13H8O
Molecular Weight180.21 g/mol
Exact Mass180.06
IUPAC Namefluoren-9-one
SMILESO=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C13H8O/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8H
InChIKeyYLQWCDOCJODRMT-UHFFFAOYSA-N
XLogP2.90
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze fluoren-9-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of fluoren-9-one?
The IUPAC name of fluoren-9-one (CID 10241) is fluoren-9-one.
What is the SMILES notation for fluoren-9-one?
The canonical SMILES for fluoren-9-one is O=C1c2ccccc2-c2ccccc21.
What is the InChIKey of fluoren-9-one?
The InChIKey is YLQWCDOCJODRMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8O/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8H.
What are the key properties of fluoren-9-one?
fluoren-9-one has a molecular weight of 180.21 g/mol, XLogP of 2.90, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for fluoren-9-one is sourced from PubChem (CID 10241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).