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Copper;ethanol;ZINC

C8H24CuO4Zn — CID 162354125

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPACcopper;ethanol;zinc
SMILESCCO.CCO.CCO.CCO.[Cu].[Zn]
InChIInChI=1S/4C2H6O.Cu.Zn/c4*1-2-3;;/h4*3H,2H2,1H3;;
InChIKeyIFETUYWYXQTHJZ-UHFFFAOYSA-N
MW313.21 g/mol
LogP-0.01
Rot. Bonds

About Copper;ethanol;ZINC

Copper;ethanol;ZINC (PubChem CID 162354125) has the molecular formula C8H24CuO4Zn and a molecular weight of 313.21 g/mol. Its IUPAC name is copper;ethanol;zinc.

Molecular Properties

Compound NameCopper;ethanol;ZINC
PubChem CID162354125
Molecular FormulaC8H24CuO4Zn
Molecular Weight313.21 g/mol
Exact Mass311.03
IUPAC Namecopper;ethanol;zinc
SMILESCCO.CCO.CCO.CCO.[Cu].[Zn]
InChIInChI=1S/4C2H6O.Cu.Zn/c4*1-2-3;;/h4*3H,2H2,1H3;;
InChIKeyIFETUYWYXQTHJZ-UHFFFAOYSA-N
XLogP-0.01
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.21
LogP ≤ 5-0.01
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of Copper;ethanol;ZINC?
The IUPAC name of Copper;ethanol;ZINC (CID 162354125) is copper;ethanol;zinc.
What is the SMILES notation for Copper;ethanol;ZINC?
The canonical SMILES for Copper;ethanol;ZINC is CCO.CCO.CCO.CCO.[Cu].[Zn].
What is the InChIKey of Copper;ethanol;ZINC?
The InChIKey is IFETUYWYXQTHJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/4C2H6O.Cu.Zn/c4*1-2-3;;/h4*3H,2H2,1H3;;.
What are the key properties of Copper;ethanol;ZINC?
Copper;ethanol;ZINC has a molecular weight of 313.21 g/mol, XLogP of -0.01, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for Copper;ethanol;ZINC is sourced from PubChem (CID 162354125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

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