8-methylfuro[3,4-f][2]benzofuran-1,3,5,7-tetrone

C11H4O6 — CID 15861434

IUPAC8-methylfuro[3,4-f][2]benzofuran-1,3,5,7-tetrone
SMILESCc1c2c(=O)oc(=O)c2cc2c(=O)oc(=O)c12
InChIInChI=1S/C11H4O6/c1-3-6-4(8(12)16-10(6)14)2-5-7(3)11(15)17-9(5)13/h2H,1H3
InChIKeyVNJSMTXECMSPRW-UHFFFAOYSA-N
MW232.15 g/mol
LogP-0.20
Rot. Bonds

About 8-methylfuro[3,4-f][2]benzofuran-1,3,5,7-tetrone

8-methylfuro[3,4-f][2]benzofuran-1,3,5,7-tetrone (PubChem CID 15861434) has the molecular formula C11H4O6 and a molecular weight of 232.15 g/mol. Its IUPAC name is 8-methylfuro[3,4-f][2]benzofuran-1,3,5,7-tetrone.

Molecular Properties

Compound Name8-methylfuro[3,4-f][2]benzofuran-1,3,5,7-tetrone
PubChem CID15861434
Molecular FormulaC11H4O6
Molecular Weight232.15 g/mol
Exact Mass232.00
IUPAC Name8-methylfuro[3,4-f][2]benzofuran-1,3,5,7-tetrone
SMILESCc1c2c(=O)oc(=O)c2cc2c(=O)oc(=O)c12
InChIInChI=1S/C11H4O6/c1-3-6-4(8(12)16-10(6)14)2-5-7(3)11(15)17-9(5)13/h2H,1H3
InChIKeyVNJSMTXECMSPRW-UHFFFAOYSA-N
XLogP-0.20
TPSA94.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.15
LogP ≤ 5-0.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 8-methylfuro[3,4-f][2]benzofuran-1,3,5,7-tetrone?
The IUPAC name of 8-methylfuro[3,4-f][2]benzofuran-1,3,5,7-tetrone (CID 15861434) is 8-methylfuro[3,4-f][2]benzofuran-1,3,5,7-tetrone.
What is the SMILES notation for 8-methylfuro[3,4-f][2]benzofuran-1,3,5,7-tetrone?
The canonical SMILES for 8-methylfuro[3,4-f][2]benzofuran-1,3,5,7-tetrone is Cc1c2c(=O)oc(=O)c2cc2c(=O)oc(=O)c12.
What is the InChIKey of 8-methylfuro[3,4-f][2]benzofuran-1,3,5,7-tetrone?
The InChIKey is VNJSMTXECMSPRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H4O6/c1-3-6-4(8(12)16-10(6)14)2-5-7(3)11(15)17-9(5)13/h2H,1H3.
What are the key properties of 8-methylfuro[3,4-f][2]benzofuran-1,3,5,7-tetrone?
8-methylfuro[3,4-f][2]benzofuran-1,3,5,7-tetrone has a molecular weight of 232.15 g/mol, XLogP of -0.20, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methylfuro[3,4-f][2]benzofuran-1,3,5,7-tetrone is sourced from PubChem (CID 15861434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).