8,9-dihydro-4H-fluorene-1,5-dione

C13H10O2 — CID 70167038

IUPAC8,9-dihydro-4H-fluorene-1,5-dione
SMILESO=C1C=CCC2=C1CC1=C2C(=O)C=CC1
InChIInChI=1S/C13H10O2/c14-11-5-2-4-9-10(11)7-8-3-1-6-12(15)13(8)9/h1-2,5-6H,3-4,7H2
InChIKeyCWPJISLICBZPMB-UHFFFAOYSA-N
MW198.22 g/mol
LogP2.04
Rot. Bonds

About 8,9-dihydro-4H-fluorene-1,5-dione

8,9-dihydro-4H-fluorene-1,5-dione (PubChem CID 70167038) has the molecular formula C13H10O2 and a molecular weight of 198.22 g/mol. Its IUPAC name is 8,9-dihydro-4H-fluorene-1,5-dione.

Molecular Properties

Compound Name8,9-dihydro-4H-fluorene-1,5-dione
PubChem CID70167038
Molecular FormulaC13H10O2
Molecular Weight198.22 g/mol
Exact Mass198.07
IUPAC Name8,9-dihydro-4H-fluorene-1,5-dione
SMILESO=C1C=CCC2=C1CC1=C2C(=O)C=CC1
InChIInChI=1S/C13H10O2/c14-11-5-2-4-9-10(11)7-8-3-1-6-12(15)13(8)9/h1-2,5-6H,3-4,7H2
InChIKeyCWPJISLICBZPMB-UHFFFAOYSA-N
XLogP2.04
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 8,9-dihydro-4H-fluorene-1,5-dione 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 8,9-dihydro-4H-fluorene-1,5-dione?
The IUPAC name of 8,9-dihydro-4H-fluorene-1,5-dione (CID 70167038) is 8,9-dihydro-4H-fluorene-1,5-dione.
What is the SMILES notation for 8,9-dihydro-4H-fluorene-1,5-dione?
The canonical SMILES for 8,9-dihydro-4H-fluorene-1,5-dione is O=C1C=CCC2=C1CC1=C2C(=O)C=CC1.
What is the InChIKey of 8,9-dihydro-4H-fluorene-1,5-dione?
The InChIKey is CWPJISLICBZPMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10O2/c14-11-5-2-4-9-10(11)7-8-3-1-6-12(15)13(8)9/h1-2,5-6H,3-4,7H2.
What are the key properties of 8,9-dihydro-4H-fluorene-1,5-dione?
8,9-dihydro-4H-fluorene-1,5-dione has a molecular weight of 198.22 g/mol, XLogP of 2.04, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8,9-dihydro-4H-fluorene-1,5-dione is sourced from PubChem (CID 70167038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).