3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione

C10H6O4 — CID 18346914

IUPAC3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione
SMILESO=C1Cc2cc3c(cc2O1)CC(=O)O3
InChIInChI=1S/C10H6O4/c11-9-3-5-1-7-6(2-8(5)14-9)4-10(12)13-7/h1-2H,3-4H2
InChIKeyCQYVZXUUXPGQEI-UHFFFAOYSA-N
MW190.15 g/mol
LogP0.61
Rot. Bonds

About 3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione

3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione (PubChem CID 18346914) has the molecular formula C10H6O4 and a molecular weight of 190.15 g/mol. Its IUPAC name is 3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione.

Molecular Properties

Compound Name3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione
PubChem CID18346914
Molecular FormulaC10H6O4
Molecular Weight190.15 g/mol
Exact Mass190.03
IUPAC Name3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione
SMILESO=C1Cc2cc3c(cc2O1)CC(=O)O3
InChIInChI=1S/C10H6O4/c11-9-3-5-1-7-6(2-8(5)14-9)4-10(12)13-7/h1-2H,3-4H2
InChIKeyCQYVZXUUXPGQEI-UHFFFAOYSA-N
XLogP0.61
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.15
LogP ≤ 50.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phenol_ester', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione?
The IUPAC name of 3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione (CID 18346914) is 3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione.
What is the SMILES notation for 3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione?
The canonical SMILES for 3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione is O=C1Cc2cc3c(cc2O1)CC(=O)O3.
What is the InChIKey of 3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione?
The InChIKey is CQYVZXUUXPGQEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6O4/c11-9-3-5-1-7-6(2-8(5)14-9)4-10(12)13-7/h1-2H,3-4H2.
What are the key properties of 3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione?
3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione has a molecular weight of 190.15 g/mol, XLogP of 0.61, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione is sourced from PubChem (CID 18346914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).