copper(1+);iron(3+);chloride;sulfate

ClCuFeO4S+ — CID 20532160

IUPACcopper(1+);iron(3+);chloride;sulfate
SMILESO=S(=O)([O-])[O-].[Cl-].[Cu+].[Fe+3]
InChIInChI=1S/ClH.Cu.Fe.H2O4S/c;;;1-5(2,3)4/h1H;;;(H2,1,2,3,4)/q;+1;+3;/p-3
InChIKeyCSNLWASHWFUCOB-UHFFFAOYSA-K
MW250.91 g/mol
LogP-4.34
Rot. Bonds

About copper(1+);iron(3+);chloride;sulfate

copper(1+);iron(3+);chloride;sulfate (PubChem CID 20532160) has the molecular formula ClCuFeO4S+ and a molecular weight of 250.91 g/mol. Its IUPAC name is copper(1+);iron(3+);chloride;sulfate.

Molecular Properties

Compound Namecopper(1+);iron(3+);chloride;sulfate
PubChem CID20532160
Molecular FormulaClCuFeO4S+
Molecular Weight250.91 g/mol
Exact Mass249.78
IUPAC Namecopper(1+);iron(3+);chloride;sulfate
SMILESO=S(=O)([O-])[O-].[Cl-].[Cu+].[Fe+3]
InChIInChI=1S/ClH.Cu.Fe.H2O4S/c;;;1-5(2,3)4/h1H;;;(H2,1,2,3,4)/q;+1;+3;/p-3
InChIKeyCSNLWASHWFUCOB-UHFFFAOYSA-K
XLogP-4.34
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.91
LogP ≤ 5-4.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}, {'alert_name': 'sulphate', 'substructure': 'N/A'}

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Related Compounds

magnesium;bis(iron(3+));dichloride;trisulfate
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zinc;copper(1+);sulfate
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CID 173070822
tetraazanium;bis(copper(1+));trisulfate
CID 173461918
diazanium;iron(3+);sulfate
CID 154825065
bis(iron(3+));trisulfate;tetrahydrate
CID 138961463
bis(iron(3+));trisulfate;henicosahydrate
CID 173056972
nickel(2+);chloride;sulfate
CID 19745759
hexadecasilver;octasulfate
CID 174664647
triazanium;azane;chloride;sulfate
CID 163745229
azanium;copper;chloride;sulfate
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azanium;iron(3+);oxygen(2-);sulfate
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Frequently Asked Questions

What is the IUPAC name of copper(1+);iron(3+);chloride;sulfate?
The IUPAC name of copper(1+);iron(3+);chloride;sulfate (CID 20532160) is copper(1+);iron(3+);chloride;sulfate.
What is the SMILES notation for copper(1+);iron(3+);chloride;sulfate?
The canonical SMILES for copper(1+);iron(3+);chloride;sulfate is O=S(=O)([O-])[O-].[Cl-].[Cu+].[Fe+3].
What is the InChIKey of copper(1+);iron(3+);chloride;sulfate?
The InChIKey is CSNLWASHWFUCOB-UHFFFAOYSA-K. The full InChI is InChI=1S/ClH.Cu.Fe.H2O4S/c;;;1-5(2,3)4/h1H;;;(H2,1,2,3,4)/q;+1;+3;/p-3.
What are the key properties of copper(1+);iron(3+);chloride;sulfate?
copper(1+);iron(3+);chloride;sulfate has a molecular weight of 250.91 g/mol, XLogP of -4.34, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for copper(1+);iron(3+);chloride;sulfate is sourced from PubChem (CID 20532160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).