10,12-dihydrobenzo[a]xanthen-9-one

C17H12O2 — CID 68748941

IUPAC10,12-dihydrobenzo[a]xanthen-9-one
SMILESO=C1C=C2Oc3ccc4ccccc4c3CC2=CC1
InChIInChI=1S/C17H12O2/c18-13-7-5-12-9-15-14-4-2-1-3-11(14)6-8-16(15)19-17(12)10-13/h1-6,8,10H,7,9H2
InChIKeyQRZABZWAOIVVCS-UHFFFAOYSA-N
MW248.28 g/mol
LogP3.56
Rot. Bonds

About 10,12-dihydrobenzo[a]xanthen-9-one

10,12-dihydrobenzo[a]xanthen-9-one (PubChem CID 68748941) has the molecular formula C17H12O2 and a molecular weight of 248.28 g/mol. Its IUPAC name is 10,12-dihydrobenzo[a]xanthen-9-one.

Molecular Properties

Compound Name10,12-dihydrobenzo[a]xanthen-9-one
PubChem CID68748941
Molecular FormulaC17H12O2
Molecular Weight248.28 g/mol
Exact Mass248.08
IUPAC Name10,12-dihydrobenzo[a]xanthen-9-one
SMILESO=C1C=C2Oc3ccc4ccccc4c3CC2=CC1
InChIInChI=1S/C17H12O2/c18-13-7-5-12-9-15-14-4-2-1-3-11(14)6-8-16(15)19-17(12)10-13/h1-6,8,10H,7,9H2
InChIKeyQRZABZWAOIVVCS-UHFFFAOYSA-N
XLogP3.56
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 10,12-dihydrobenzo[a]xanthen-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 10,12-dihydrobenzo[a]xanthen-9-one?
The IUPAC name of 10,12-dihydrobenzo[a]xanthen-9-one (CID 68748941) is 10,12-dihydrobenzo[a]xanthen-9-one.
What is the SMILES notation for 10,12-dihydrobenzo[a]xanthen-9-one?
The canonical SMILES for 10,12-dihydrobenzo[a]xanthen-9-one is O=C1C=C2Oc3ccc4ccccc4c3CC2=CC1.
What is the InChIKey of 10,12-dihydrobenzo[a]xanthen-9-one?
The InChIKey is QRZABZWAOIVVCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12O2/c18-13-7-5-12-9-15-14-4-2-1-3-11(14)6-8-16(15)19-17(12)10-13/h1-6,8,10H,7,9H2.
What are the key properties of 10,12-dihydrobenzo[a]xanthen-9-one?
10,12-dihydrobenzo[a]xanthen-9-one has a molecular weight of 248.28 g/mol, XLogP of 3.56, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10,12-dihydrobenzo[a]xanthen-9-one is sourced from PubChem (CID 68748941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).