copper;iron;dihydroxide;dihydrate

H6CuFe2O4 — CID 138991746

IUPACcopper;iron;dihydroxide;dihydrate
SMILESO.O.[Cu+2].[Fe].[Fe].[OH-].[OH-]
InChIInChI=1S/Cu.2Fe.4H2O/h;;;4*1H2/q+2;;;;;;/p-2
InChIKeyXTXLEMIZIKEADY-UHFFFAOYSA-L
MW245.28 g/mol
LogP-2.01
Rot. Bonds

About copper;iron;dihydroxide;dihydrate

copper;iron;dihydroxide;dihydrate (PubChem CID 138991746) has the molecular formula H6CuFe2O4 and a molecular weight of 245.28 g/mol. Its IUPAC name is copper;iron;dihydroxide;dihydrate.

Molecular Properties

Compound Namecopper;iron;dihydroxide;dihydrate
PubChem CID138991746
Molecular FormulaH6CuFe2O4
Molecular Weight245.28 g/mol
Exact Mass244.83
IUPAC Namecopper;iron;dihydroxide;dihydrate
SMILESO.O.[Cu+2].[Fe].[Fe].[OH-].[OH-]
InChIInChI=1S/Cu.2Fe.4H2O/h;;;4*1H2/q+2;;;;;;/p-2
InChIKeyXTXLEMIZIKEADY-UHFFFAOYSA-L
XLogP-2.01
TPSA123.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 5-2.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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iron;dodecahydrate
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iron;hydrate
CID 173302268
iron;trihydrate
CID 56841934
ruthenium(2+) dihydroxide
CID 160935827
copper tetrahydroxide
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iron dihydride;hydrate
CID 175916481
iron;tridecahydrate
CID 173126990
iron;undecahydrate
CID 42626946

Frequently Asked Questions

What is the IUPAC name of copper;iron;dihydroxide;dihydrate?
The IUPAC name of copper;iron;dihydroxide;dihydrate (CID 138991746) is copper;iron;dihydroxide;dihydrate.
What is the SMILES notation for copper;iron;dihydroxide;dihydrate?
The canonical SMILES for copper;iron;dihydroxide;dihydrate is O.O.[Cu+2].[Fe].[Fe].[OH-].[OH-].
What is the InChIKey of copper;iron;dihydroxide;dihydrate?
The InChIKey is XTXLEMIZIKEADY-UHFFFAOYSA-L. The full InChI is InChI=1S/Cu.2Fe.4H2O/h;;;4*1H2/q+2;;;;;;/p-2.
What are the key properties of copper;iron;dihydroxide;dihydrate?
copper;iron;dihydroxide;dihydrate has a molecular weight of 245.28 g/mol, XLogP of -2.01, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for copper;iron;dihydroxide;dihydrate is sourced from PubChem (CID 138991746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).