copper bis(quinolin-8-olate)

C18H12CuN2O2 — CID 56840841

IUPACcopper bis(quinolin-8-olate)
SMILES[Cu+2].[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12
InChIInChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2
InChIKeyYXLXNENXOJSQEI-UHFFFAOYSA-L
MW351.85 g/mol
LogP2.61
Rot. Bonds

About copper bis(quinolin-8-olate)

copper bis(quinolin-8-olate) (PubChem CID 56840841) has the molecular formula C18H12CuN2O2 and a molecular weight of 351.85 g/mol. Its IUPAC name is copper bis(quinolin-8-olate).

Molecular Properties

Compound Namecopper bis(quinolin-8-olate)
PubChem CID56840841
Molecular FormulaC18H12CuN2O2
Molecular Weight351.85 g/mol
Exact Mass351.02
IUPAC Namecopper bis(quinolin-8-olate)
SMILES[Cu+2].[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12
InChIInChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2
InChIKeyYXLXNENXOJSQEI-UHFFFAOYSA-L
XLogP2.61
TPSA71.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.85
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of copper bis(quinolin-8-olate)?
The IUPAC name of copper bis(quinolin-8-olate) (CID 56840841) is copper bis(quinolin-8-olate).
What is the SMILES notation for copper bis(quinolin-8-olate)?
The canonical SMILES for copper bis(quinolin-8-olate) is [Cu+2].[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.
What is the InChIKey of copper bis(quinolin-8-olate)?
The InChIKey is YXLXNENXOJSQEI-UHFFFAOYSA-L. The full InChI is InChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2.
What are the key properties of copper bis(quinolin-8-olate)?
copper bis(quinolin-8-olate) has a molecular weight of 351.85 g/mol, XLogP of 2.61, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for copper bis(quinolin-8-olate) is sourced from PubChem (CID 56840841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).