cadmium;mercury;selenic acid

H2CdHgO4Se — CID 174894760

IUPACcadmium;mercury;selenic acid
SMILESO=[Se](=O)(O)O.[Cd].[Hg]
InChIInChI=1S/Cd.Hg.H2O4Se/c;;1-5(2,3)4/h;;(H2,1,2,3,4)
InChIKeyPYMRUWAGWIBPDN-UHFFFAOYSA-N
MW457.97 g/mol
LogP-1.74
Rot. Bonds

About cadmium;mercury;selenic acid

cadmium;mercury;selenic acid (PubChem CID 174894760) has the molecular formula H2CdHgO4Se and a molecular weight of 457.97 g/mol. Its IUPAC name is cadmium;mercury;selenic acid.

Molecular Properties

Compound Namecadmium;mercury;selenic acid
PubChem CID174894760
Molecular FormulaH2CdHgO4Se
Molecular Weight457.97 g/mol
Exact Mass461.79
IUPAC Namecadmium;mercury;selenic acid
SMILESO=[Se](=O)(O)O.[Cd].[Hg]
InChIInChI=1S/Cd.Hg.H2O4Se/c;;1-5(2,3)4/h;;(H2,1,2,3,4)
InChIKeyPYMRUWAGWIBPDN-UHFFFAOYSA-N
XLogP-1.74
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500457.97
LogP ≤ 5-1.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 cadmium;mercury;selenic acid?
The IUPAC name of cadmium;mercury;selenic acid (CID 174894760) is cadmium;mercury;selenic acid.
What is the SMILES notation for cadmium;mercury;selenic acid?
The canonical SMILES for cadmium;mercury;selenic acid is O=[Se](=O)(O)O.[Cd].[Hg].
What is the InChIKey of cadmium;mercury;selenic acid?
The InChIKey is PYMRUWAGWIBPDN-UHFFFAOYSA-N. The full InChI is InChI=1S/Cd.Hg.H2O4Se/c;;1-5(2,3)4/h;;(H2,1,2,3,4).
What are the key properties of cadmium;mercury;selenic acid?
cadmium;mercury;selenic acid has a molecular weight of 457.97 g/mol, XLogP of -1.74, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cadmium;mercury;selenic acid is sourced from PubChem (CID 174894760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).