iron;sulfuric acid;zirconium;tetrahydrochloride

H6Cl4FeO4SZr — CID 174734672

IUPACiron;sulfuric acid;zirconium;tetrahydrochloride
SMILESCl.Cl.Cl.Cl.O=S(=O)(O)O.[Fe].[Zr]
InChIInChI=1S/4ClH.Fe.H2O4S.Zr/c;;;;;1-5(2,3)4;/h4*1H;;(H2,1,2,3,4);
InChIKeyUWBRWJBMXFAMQE-UHFFFAOYSA-N
MW390.99 g/mol
LogP1.03
Rot. Bonds

About iron;sulfuric acid;zirconium;tetrahydrochloride

iron;sulfuric acid;zirconium;tetrahydrochloride (PubChem CID 174734672) has the molecular formula H6Cl4FeO4SZr and a molecular weight of 390.99 g/mol. Its IUPAC name is iron;sulfuric acid;zirconium;tetrahydrochloride.

Molecular Properties

Compound Nameiron;sulfuric acid;zirconium;tetrahydrochloride
PubChem CID174734672
Molecular FormulaH6Cl4FeO4SZr
Molecular Weight390.99 g/mol
Exact Mass387.71
IUPAC Nameiron;sulfuric acid;zirconium;tetrahydrochloride
SMILESCl.Cl.Cl.Cl.O=S(=O)(O)O.[Fe].[Zr]
InChIInChI=1S/4ClH.Fe.H2O4S.Zr/c;;;;;1-5(2,3)4;/h4*1H;;(H2,1,2,3,4);
InChIKeyUWBRWJBMXFAMQE-UHFFFAOYSA-N
XLogP1.03
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.99
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of iron;sulfuric acid;zirconium;tetrahydrochloride?
The IUPAC name of iron;sulfuric acid;zirconium;tetrahydrochloride (CID 174734672) is iron;sulfuric acid;zirconium;tetrahydrochloride.
What is the SMILES notation for iron;sulfuric acid;zirconium;tetrahydrochloride?
The canonical SMILES for iron;sulfuric acid;zirconium;tetrahydrochloride is Cl.Cl.Cl.Cl.O=S(=O)(O)O.[Fe].[Zr].
What is the InChIKey of iron;sulfuric acid;zirconium;tetrahydrochloride?
The InChIKey is UWBRWJBMXFAMQE-UHFFFAOYSA-N. The full InChI is InChI=1S/4ClH.Fe.H2O4S.Zr/c;;;;;1-5(2,3)4;/h4*1H;;(H2,1,2,3,4);.
What are the key properties of iron;sulfuric acid;zirconium;tetrahydrochloride?
iron;sulfuric acid;zirconium;tetrahydrochloride has a molecular weight of 390.99 g/mol, XLogP of 1.03, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for iron;sulfuric acid;zirconium;tetrahydrochloride is sourced from PubChem (CID 174734672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).