2-phenoxybenzo[c]chromen-6-one

C19H12O3 — CID 164686095

IUPAC2-phenoxybenzo[c]chromen-6-one
SMILESO=c1oc2ccc(Oc3ccccc3)cc2c2ccccc12
InChIInChI=1S/C19H12O3/c20-19-16-9-5-4-8-15(16)17-12-14(10-11-18(17)22-19)21-13-6-2-1-3-7-13/h1-12H
InChIKeyFNXLJLDPDGLEGW-UHFFFAOYSA-N
MW288.30 g/mol
LogP4.74
Rot. Bonds2

About 2-phenoxybenzo[c]chromen-6-one

2-phenoxybenzo[c]chromen-6-one (PubChem CID 164686095) has the molecular formula C19H12O3 and a molecular weight of 288.30 g/mol. Its IUPAC name is 2-phenoxybenzo[c]chromen-6-one.

Molecular Properties

Compound Name2-phenoxybenzo[c]chromen-6-one
PubChem CID164686095
Molecular FormulaC19H12O3
Molecular Weight288.30 g/mol
Exact Mass288.08
IUPAC Name2-phenoxybenzo[c]chromen-6-one
SMILESO=c1oc2ccc(Oc3ccccc3)cc2c2ccccc12
InChIInChI=1S/C19H12O3/c20-19-16-9-5-4-8-15(16)17-12-14(10-11-18(17)22-19)21-13-6-2-1-3-7-13/h1-12H
InChIKeyFNXLJLDPDGLEGW-UHFFFAOYSA-N
XLogP4.74
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.30
LogP ≤ 54.74
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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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-phenoxybenzo[c]chromen-6-one?
The IUPAC name of 2-phenoxybenzo[c]chromen-6-one (CID 164686095) is 2-phenoxybenzo[c]chromen-6-one.
What is the SMILES notation for 2-phenoxybenzo[c]chromen-6-one?
The canonical SMILES for 2-phenoxybenzo[c]chromen-6-one is O=c1oc2ccc(Oc3ccccc3)cc2c2ccccc12.
What is the InChIKey of 2-phenoxybenzo[c]chromen-6-one?
The InChIKey is FNXLJLDPDGLEGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12O3/c20-19-16-9-5-4-8-15(16)17-12-14(10-11-18(17)22-19)21-13-6-2-1-3-7-13/h1-12H.
What are the key properties of 2-phenoxybenzo[c]chromen-6-one?
2-phenoxybenzo[c]chromen-6-one has a molecular weight of 288.30 g/mol, XLogP of 4.74, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxybenzo[c]chromen-6-one is sourced from PubChem (CID 164686095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).