2-(furan-2-yl)benzo[h]chromen-4-one

C17H10O3 — CID 755079

IUPAC2-(furan-2-yl)benzo[h]chromen-4-one
SMILESO=c1cc(-c2ccco2)oc2c1ccc1ccccc12
InChIInChI=1S/C17H10O3/c18-14-10-16(15-6-3-9-19-15)20-17-12-5-2-1-4-11(12)7-8-13(14)17/h1-10H
InChIKeySRVDFXLDXBTOCR-UHFFFAOYSA-N
MW262.26 g/mol
LogP4.21
Rot. Bonds1

About 2-(furan-2-yl)benzo[h]chromen-4-one

2-(furan-2-yl)benzo[h]chromen-4-one (PubChem CID 755079) has the molecular formula C17H10O3 and a molecular weight of 262.26 g/mol. Its IUPAC name is 2-(furan-2-yl)benzo[h]chromen-4-one.

Molecular Properties

Compound Name2-(furan-2-yl)benzo[h]chromen-4-one
PubChem CID755079
Molecular FormulaC17H10O3
Molecular Weight262.26 g/mol
Exact Mass262.06
IUPAC Name2-(furan-2-yl)benzo[h]chromen-4-one
SMILESO=c1cc(-c2ccco2)oc2c1ccc1ccccc12
InChIInChI=1S/C17H10O3/c18-14-10-16(15-6-3-9-19-15)20-17-12-5-2-1-4-11(12)7-8-13(14)17/h1-10H
InChIKeySRVDFXLDXBTOCR-UHFFFAOYSA-N
XLogP4.21
TPSA43.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.26
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)benzo[h]chromen-4-one?
The IUPAC name of 2-(furan-2-yl)benzo[h]chromen-4-one (CID 755079) is 2-(furan-2-yl)benzo[h]chromen-4-one.
What is the SMILES notation for 2-(furan-2-yl)benzo[h]chromen-4-one?
The canonical SMILES for 2-(furan-2-yl)benzo[h]chromen-4-one is O=c1cc(-c2ccco2)oc2c1ccc1ccccc12.
What is the InChIKey of 2-(furan-2-yl)benzo[h]chromen-4-one?
The InChIKey is SRVDFXLDXBTOCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10O3/c18-14-10-16(15-6-3-9-19-15)20-17-12-5-2-1-4-11(12)7-8-13(14)17/h1-10H.
What are the key properties of 2-(furan-2-yl)benzo[h]chromen-4-one?
2-(furan-2-yl)benzo[h]chromen-4-one has a molecular weight of 262.26 g/mol, XLogP of 4.21, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)benzo[h]chromen-4-one is sourced from PubChem (CID 755079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).