[1]benzofuro[7,6-h]chromen-8-one

C15H8O3 — CID 57357836

IUPAC[1]benzofuro[7,6-h]chromen-8-one
SMILESO=c1ccc2ccc3c(ccc4ccoc43)c2o1
InChIInChI=1S/C15H8O3/c16-13-6-3-9-1-4-11-12(15(9)18-13)5-2-10-7-8-17-14(10)11/h1-8H
InChIKeyAPZLTTDPQKUMCY-UHFFFAOYSA-N
MW236.23 g/mol
LogP3.69
Rot. Bonds

About [1]benzofuro[7,6-h]chromen-8-one

[1]benzofuro[7,6-h]chromen-8-one (PubChem CID 57357836) has the molecular formula C15H8O3 and a molecular weight of 236.23 g/mol. Its IUPAC name is [1]benzofuro[7,6-h]chromen-8-one.

Molecular Properties

Compound Name[1]benzofuro[7,6-h]chromen-8-one
PubChem CID57357836
Molecular FormulaC15H8O3
Molecular Weight236.23 g/mol
Exact Mass236.05
IUPAC Name[1]benzofuro[7,6-h]chromen-8-one
SMILESO=c1ccc2ccc3c(ccc4ccoc43)c2o1
InChIInChI=1S/C15H8O3/c16-13-6-3-9-1-4-11-12(15(9)18-13)5-2-10-7-8-17-14(10)11/h1-8H
InChIKeyAPZLTTDPQKUMCY-UHFFFAOYSA-N
XLogP3.69
TPSA43.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.23
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [1]benzofuro[7,6-h]chromen-8-one?
The IUPAC name of [1]benzofuro[7,6-h]chromen-8-one (CID 57357836) is [1]benzofuro[7,6-h]chromen-8-one.
What is the SMILES notation for [1]benzofuro[7,6-h]chromen-8-one?
The canonical SMILES for [1]benzofuro[7,6-h]chromen-8-one is O=c1ccc2ccc3c(ccc4ccoc43)c2o1.
What is the InChIKey of [1]benzofuro[7,6-h]chromen-8-one?
The InChIKey is APZLTTDPQKUMCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8O3/c16-13-6-3-9-1-4-11-12(15(9)18-13)5-2-10-7-8-17-14(10)11/h1-8H.
What are the key properties of [1]benzofuro[7,6-h]chromen-8-one?
[1]benzofuro[7,6-h]chromen-8-one has a molecular weight of 236.23 g/mol, XLogP of 3.69, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1]benzofuro[7,6-h]chromen-8-one is sourced from PubChem (CID 57357836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).