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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Related Compounds

[2]benzofuro[5,4-e][2]benzofuran-1,3,6,8-tetrone;6-methylidene-[2]benzofuro[4,5-g][2]benzofuran-1,3,8-trione
CID 158669225
6-bromobenzo[e][2]benzofuran-1,3-dione
CID 87755748
5-hydroxynaphtho[2,1-e][2]benzofuran-1,3-dione
CID 11402825
7,8-bis(ethenyl)benzo[e][2]benzofuran-1,3-dione
CID 144902513
6-methylidene-4-phenylfuro[3,4-e][2]benzofuran-1,3,8-trione
CID 143653389
5-[(3-methylidene-1-oxo-2-benzofuran-5-yl)methyl]-2-benzofuran-1,3-dione
CID 156576329
4,5-difluoro-2-benzofuran-1,3-dione
CID 15106096
5,7,14,16-tetraoxo-6,15-dioxatetracyclo[9.7.0.04,17.08,13]octadeca-1(18),2,4(17),8(13),9,11-hexaene-12,18-dicarbonitrile
CID 90918962
1,6-dimethylidene-[1]benzofuro[7,6-g][1]benzofuran-2,7-dione;ethane
CID 144622524
23-methylidene-7,24-dioxahexacyclo[18.7.0.03,11.05,9.013,18.022,26]heptacosa-1(27),3,5(9),10,13,15,17,20,22(26)-nonaene-6,8,25-trione
CID 123358491
17-methyl-7,14-dioxapentacyclo[11.8.0.02,10.05,9.015,20]henicosa-1(13),2(10),3,5(9),11,15(20),16,18-octaene-6,8-dione
CID 54527768
7,12-dioxatetracyclo[12.3.1.02,9.05,10]octadeca-1(18),2(9),3,5(10),14,16-hexaene-6,8,11,13-tetrone
CID 56628669

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).