copper;sodium;hydrogen sulfite;sulfate

HCuNaO7S2 — CID 160627892

IUPACcopper;sodium;hydrogen sulfite;sulfate
SMILESO=S(=O)([O-])[O-].O=S([O-])O.[Cu+2].[Na+]
InChIInChI=1S/Cu.Na.H2O4S.H2O3S/c;;1-5(2,3)4;1-4(2)3/h;;(H2,1,2,3,4);(H2,1,2,3)/q+2;+1;;/p-3
InChIKeyRHNSUVIKTMWLKK-UHFFFAOYSA-K
MW263.67 g/mol
LogP-5.00
Rot. Bonds

About copper;sodium;hydrogen sulfite;sulfate

copper;sodium;hydrogen sulfite;sulfate (PubChem CID 160627892) has the molecular formula HCuNaO7S2 and a molecular weight of 263.67 g/mol. Its IUPAC name is copper;sodium;hydrogen sulfite;sulfate.

Molecular Properties

Compound Namecopper;sodium;hydrogen sulfite;sulfate
PubChem CID160627892
Molecular FormulaHCuNaO7S2
Molecular Weight263.67 g/mol
Exact Mass262.84
IUPAC Namecopper;sodium;hydrogen sulfite;sulfate
SMILESO=S(=O)([O-])[O-].O=S([O-])O.[Cu+2].[Na+]
InChIInChI=1S/Cu.Na.H2O4S.H2O3S/c;;1-5(2,3)4;1-4(2)3/h;;(H2,1,2,3,4);(H2,1,2,3)/q+2;+1;;/p-3
InChIKeyRHNSUVIKTMWLKK-UHFFFAOYSA-K
XLogP-5.00
TPSA140.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.67
LogP ≤ 5-5.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of copper;sodium;hydrogen sulfite;sulfate?
The IUPAC name of copper;sodium;hydrogen sulfite;sulfate (CID 160627892) is copper;sodium;hydrogen sulfite;sulfate.
What is the SMILES notation for copper;sodium;hydrogen sulfite;sulfate?
The canonical SMILES for copper;sodium;hydrogen sulfite;sulfate is O=S(=O)([O-])[O-].O=S([O-])O.[Cu+2].[Na+].
What is the InChIKey of copper;sodium;hydrogen sulfite;sulfate?
The InChIKey is RHNSUVIKTMWLKK-UHFFFAOYSA-K. The full InChI is InChI=1S/Cu.Na.H2O4S.H2O3S/c;;1-5(2,3)4;1-4(2)3/h;;(H2,1,2,3,4);(H2,1,2,3)/q+2;+1;;/p-3.
What are the key properties of copper;sodium;hydrogen sulfite;sulfate?
copper;sodium;hydrogen sulfite;sulfate has a molecular weight of 263.67 g/mol, XLogP of -5.00, 0 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for copper;sodium;hydrogen sulfite;sulfate is sourced from PubChem (CID 160627892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).