furo[2,3-h]chromen-2-one

C11H6O3 — CID 10658

IUPACfuro[2,3-h]chromen-2-one
SMILESO=c1ccc2ccc3occc3c2o1
InChIInChI=1S/C11H6O3/c12-10-4-2-7-1-3-9-8(5-6-13-9)11(7)14-10/h1-6H
InChIKeyXDROKJSWHURZGO-UHFFFAOYSA-N
MW186.17 g/mol
LogP2.54
Rot. Bonds

About furo[2,3-h]chromen-2-one

furo[2,3-h]chromen-2-one (PubChem CID 10658) has the molecular formula C11H6O3 and a molecular weight of 186.17 g/mol. Its IUPAC name is furo[2,3-h]chromen-2-one.

Molecular Properties

Compound Namefuro[2,3-h]chromen-2-one
PubChem CID10658
Molecular FormulaC11H6O3
Molecular Weight186.17 g/mol
Exact Mass186.03
IUPAC Namefuro[2,3-h]chromen-2-one
SMILESO=c1ccc2ccc3occc3c2o1
InChIInChI=1S/C11H6O3/c12-10-4-2-7-1-3-9-8(5-6-13-9)11(7)14-10/h1-6H
InChIKeyXDROKJSWHURZGO-UHFFFAOYSA-N
XLogP2.54
TPSA43.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.17
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of furo[2,3-h]chromen-2-one?
The IUPAC name of furo[2,3-h]chromen-2-one (CID 10658) is furo[2,3-h]chromen-2-one.
What is the SMILES notation for furo[2,3-h]chromen-2-one?
The canonical SMILES for furo[2,3-h]chromen-2-one is O=c1ccc2ccc3occc3c2o1.
What is the InChIKey of furo[2,3-h]chromen-2-one?
The InChIKey is XDROKJSWHURZGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6O3/c12-10-4-2-7-1-3-9-8(5-6-13-9)11(7)14-10/h1-6H.
What are the key properties of furo[2,3-h]chromen-2-one?
furo[2,3-h]chromen-2-one has a molecular weight of 186.17 g/mol, XLogP of 2.54, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furo[2,3-h]chromen-2-one is sourced from PubChem (CID 10658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).