furo[3,4-e][2]benzofuran-1,3,6,8-tetrone

C10H2O6 — CID 15606522

IUPACfuro[3,4-e][2]benzofuran-1,3,6,8-tetrone
SMILESO=c1oc(=O)c2c1ccc1c(=O)oc(=O)c12
InChIInChI=1S/C10H2O6/c11-7-3-1-2-4-6(5(3)9(13)15-7)10(14)16-8(4)12/h1-2H
InChIKeyOPVUAMHJYLRIBC-UHFFFAOYSA-N
MW218.12 g/mol
LogP-0.50
Rot. Bonds

About furo[3,4-e][2]benzofuran-1,3,6,8-tetrone

furo[3,4-e][2]benzofuran-1,3,6,8-tetrone (PubChem CID 15606522) has the molecular formula C10H2O6 and a molecular weight of 218.12 g/mol. Its IUPAC name is furo[3,4-e][2]benzofuran-1,3,6,8-tetrone.

Molecular Properties

Compound Namefuro[3,4-e][2]benzofuran-1,3,6,8-tetrone
PubChem CID15606522
Molecular FormulaC10H2O6
Molecular Weight218.12 g/mol
Exact Mass217.99
IUPAC Namefuro[3,4-e][2]benzofuran-1,3,6,8-tetrone
SMILESO=c1oc(=O)c2c1ccc1c(=O)oc(=O)c12
InChIInChI=1S/C10H2O6/c11-7-3-1-2-4-6(5(3)9(13)15-7)10(14)16-8(4)12/h1-2H
InChIKeyOPVUAMHJYLRIBC-UHFFFAOYSA-N
XLogP-0.50
TPSA94.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.12
LogP ≤ 5-0.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of furo[3,4-e][2]benzofuran-1,3,6,8-tetrone?
The IUPAC name of furo[3,4-e][2]benzofuran-1,3,6,8-tetrone (CID 15606522) is furo[3,4-e][2]benzofuran-1,3,6,8-tetrone.
What is the SMILES notation for furo[3,4-e][2]benzofuran-1,3,6,8-tetrone?
The canonical SMILES for furo[3,4-e][2]benzofuran-1,3,6,8-tetrone is O=c1oc(=O)c2c1ccc1c(=O)oc(=O)c12.
What is the InChIKey of furo[3,4-e][2]benzofuran-1,3,6,8-tetrone?
The InChIKey is OPVUAMHJYLRIBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H2O6/c11-7-3-1-2-4-6(5(3)9(13)15-7)10(14)16-8(4)12/h1-2H.
What are the key properties of furo[3,4-e][2]benzofuran-1,3,6,8-tetrone?
furo[3,4-e][2]benzofuran-1,3,6,8-tetrone has a molecular weight of 218.12 g/mol, XLogP of -0.50, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for furo[3,4-e][2]benzofuran-1,3,6,8-tetrone is sourced from PubChem (CID 15606522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).