6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione

C15H6O5 — CID 134285624

IUPAC6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione
SMILESC=C1OC(=O)c2c1ccc1c3c(ccc21)C(=O)OC3=O
InChIInChI=1S/C15H6O5/c1-6-7-2-3-9-8(11(7)14(17)19-6)4-5-10-12(9)15(18)20-13(10)16/h2-5H,1H2
InChIKeyMNSZAMOFGLGDQK-UHFFFAOYSA-N
MW266.21 g/mol
LogP2.29
Rot. Bonds

About 6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione

6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione (PubChem CID 134285624) has the molecular formula C15H6O5 and a molecular weight of 266.21 g/mol. Its IUPAC name is 6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione.

Molecular Properties

Compound Name6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione
PubChem CID134285624
Molecular FormulaC15H6O5
Molecular Weight266.21 g/mol
Exact Mass266.02
IUPAC Name6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione
SMILESC=C1OC(=O)c2c1ccc1c3c(ccc21)C(=O)OC3=O
InChIInChI=1S/C15H6O5/c1-6-7-2-3-9-8(11(7)14(17)19-6)4-5-10-12(9)15(18)20-13(10)16/h2-5H,1H2
InChIKeyMNSZAMOFGLGDQK-UHFFFAOYSA-N
XLogP2.29
TPSA69.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.21
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione?
The IUPAC name of 6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione (CID 134285624) is 6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione.
What is the SMILES notation for 6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione?
The canonical SMILES for 6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione is C=C1OC(=O)c2c1ccc1c3c(ccc21)C(=O)OC3=O.
What is the InChIKey of 6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione?
The InChIKey is MNSZAMOFGLGDQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H6O5/c1-6-7-2-3-9-8(11(7)14(17)19-6)4-5-10-12(9)15(18)20-13(10)16/h2-5H,1H2.
What are the key properties of 6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione?
6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione has a molecular weight of 266.21 g/mol, XLogP of 2.29, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione is sourced from PubChem (CID 134285624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).