1,5a-dihydrodibenzofuran-2,8-dione

C12H8O3 — CID 118643169

IUPAC1,5a-dihydrodibenzofuran-2,8-dione
SMILESO=C1C=CC2OC3=C(CC(=O)C=C3)C2=C1
InChIInChI=1S/C12H8O3/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11/h1-5,11H,6H2
InChIKeyUQMFTVCBFJCOLK-UHFFFAOYSA-N
MW200.19 g/mol
LogP1.23
Rot. Bonds

About 1,5a-dihydrodibenzofuran-2,8-dione

1,5a-dihydrodibenzofuran-2,8-dione (PubChem CID 118643169) has the molecular formula C12H8O3 and a molecular weight of 200.19 g/mol. Its IUPAC name is 1,5a-dihydrodibenzofuran-2,8-dione.

Molecular Properties

Compound Name1,5a-dihydrodibenzofuran-2,8-dione
PubChem CID118643169
Molecular FormulaC12H8O3
Molecular Weight200.19 g/mol
Exact Mass200.05
IUPAC Name1,5a-dihydrodibenzofuran-2,8-dione
SMILESO=C1C=CC2OC3=C(CC(=O)C=C3)C2=C1
InChIInChI=1S/C12H8O3/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11/h1-5,11H,6H2
InChIKeyUQMFTVCBFJCOLK-UHFFFAOYSA-N
XLogP1.23
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.19
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,5a-dihydrodibenzofuran-2,8-dione?
The IUPAC name of 1,5a-dihydrodibenzofuran-2,8-dione (CID 118643169) is 1,5a-dihydrodibenzofuran-2,8-dione.
What is the SMILES notation for 1,5a-dihydrodibenzofuran-2,8-dione?
The canonical SMILES for 1,5a-dihydrodibenzofuran-2,8-dione is O=C1C=CC2OC3=C(CC(=O)C=C3)C2=C1.
What is the InChIKey of 1,5a-dihydrodibenzofuran-2,8-dione?
The InChIKey is UQMFTVCBFJCOLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8O3/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11/h1-5,11H,6H2.
What are the key properties of 1,5a-dihydrodibenzofuran-2,8-dione?
1,5a-dihydrodibenzofuran-2,8-dione has a molecular weight of 200.19 g/mol, XLogP of 1.23, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5a-dihydrodibenzofuran-2,8-dione is sourced from PubChem (CID 118643169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).