cadmium;mercury;hydrate

H2CdHgO — CID 173443833

IUPACcadmium;mercury;hydrate
SMILESO.[Cd].[Hg]
InChIInChI=1S/Cd.Hg.H2O/h;;1H2
InChIKeyBURHVHRKSHKIDE-UHFFFAOYSA-N
MW331.02 g/mol
LogP-0.83
Rot. Bonds

About cadmium;mercury;hydrate

cadmium;mercury;hydrate (PubChem CID 173443833) has the molecular formula H2CdHgO and a molecular weight of 331.02 g/mol. Its IUPAC name is cadmium;mercury;hydrate.

Molecular Properties

Compound Namecadmium;mercury;hydrate
PubChem CID173443833
Molecular FormulaH2CdHgO
Molecular Weight331.02 g/mol
Exact Mass333.88
IUPAC Namecadmium;mercury;hydrate
SMILESO.[Cd].[Hg]
InChIInChI=1S/Cd.Hg.H2O/h;;1H2
InChIKeyBURHVHRKSHKIDE-UHFFFAOYSA-N
XLogP-0.83
TPSA31.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms3
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.02
LogP ≤ 5-0.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze cadmium;mercury;hydrate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of cadmium;mercury;hydrate?
The IUPAC name of cadmium;mercury;hydrate (CID 173443833) is cadmium;mercury;hydrate.
What is the SMILES notation for cadmium;mercury;hydrate?
The canonical SMILES for cadmium;mercury;hydrate is O.[Cd].[Hg].
What is the InChIKey of cadmium;mercury;hydrate?
The InChIKey is BURHVHRKSHKIDE-UHFFFAOYSA-N. The full InChI is InChI=1S/Cd.Hg.H2O/h;;1H2.
What are the key properties of cadmium;mercury;hydrate?
cadmium;mercury;hydrate has a molecular weight of 331.02 g/mol, XLogP of -0.83, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cadmium;mercury;hydrate is sourced from PubChem (CID 173443833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).