cadmium(2+);sulfane;sulfate

H2CdO4S2 — CID 174596003

IUPACcadmium(2+);sulfane;sulfate
SMILESO=S(=O)([O-])[O-].S.[Cd+2]
InChIInChI=1S/Cd.H2O4S.H2S/c;1-5(2,3)4;/h;(H2,1,2,3,4);1H2/q+2;;/p-2
InChIKeyUDJWJGURBZCUEB-UHFFFAOYSA-L
MW242.56 g/mol
LogP-1.23
Rot. Bonds

About cadmium(2+);sulfane;sulfate

cadmium(2+);sulfane;sulfate (PubChem CID 174596003) has the molecular formula H2CdO4S2 and a molecular weight of 242.56 g/mol. Its IUPAC name is cadmium(2+);sulfane;sulfate.

Molecular Properties

Compound Namecadmium(2+);sulfane;sulfate
PubChem CID174596003
Molecular FormulaH2CdO4S2
Molecular Weight242.56 g/mol
Exact Mass243.84
IUPAC Namecadmium(2+);sulfane;sulfate
SMILESO=S(=O)([O-])[O-].S.[Cd+2]
InChIInChI=1S/Cd.H2O4S.H2S/c;1-5(2,3)4;/h;(H2,1,2,3,4);1H2/q+2;;/p-2
InChIKeyUDJWJGURBZCUEB-UHFFFAOYSA-L
XLogP-1.23
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.56
LogP ≤ 5-1.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze cadmium(2+);sulfane;sulfate with MolForge

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

Launch Full Analysis

Related Compounds

hexadecasilver;octasulfate
CID 174664647
CID 172803034
CID 172803034
cadmium(2+);tin(2+);dichloride;sulfate
CID 175569945
silver;zinc;sulfate
CID 157447446
tris(vanadium);pentasulfate
CID 173042063
dilithium;cobalt;sulfate
CID 174060420
octaazanium;tetrasulfate
CID 86742620
CID 23615458
CID 23615458
aluminum;lithium;sulfate
CID 23446975
azanium sulfate
CID 21225610
cerium trisulfate
CID 160867766
octacosacopper;pentasulfate
CID 173053964

Frequently Asked Questions

What is the IUPAC name of cadmium(2+);sulfane;sulfate?
The IUPAC name of cadmium(2+);sulfane;sulfate (CID 174596003) is cadmium(2+);sulfane;sulfate.
What is the SMILES notation for cadmium(2+);sulfane;sulfate?
The canonical SMILES for cadmium(2+);sulfane;sulfate is O=S(=O)([O-])[O-].S.[Cd+2].
What is the InChIKey of cadmium(2+);sulfane;sulfate?
The InChIKey is UDJWJGURBZCUEB-UHFFFAOYSA-L. The full InChI is InChI=1S/Cd.H2O4S.H2S/c;1-5(2,3)4;/h;(H2,1,2,3,4);1H2/q+2;;/p-2.
What are the key properties of cadmium(2+);sulfane;sulfate?
cadmium(2+);sulfane;sulfate has a molecular weight of 242.56 g/mol, XLogP of -1.23, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cadmium(2+);sulfane;sulfate is sourced from PubChem (CID 174596003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).