chloro hypochlorite;zinc;hydrate

H2Cl2O2Zn — CID 159750781

IUPACchloro hypochlorite;zinc;hydrate
SMILESClOCl.O.[Zn]
InChIInChI=1S/Cl2O.H2O.Zn/c1-3-2;;/h;1H2;
InChIKeyNDPUEPKMJNGUTA-UHFFFAOYSA-N
MW170.31 g/mol
LogP0.48
Rot. Bonds

About chloro hypochlorite;zinc;hydrate

chloro hypochlorite;zinc;hydrate (PubChem CID 159750781) has the molecular formula H2Cl2O2Zn and a molecular weight of 170.31 g/mol. Its IUPAC name is chloro hypochlorite;zinc;hydrate.

Molecular Properties

Compound Namechloro hypochlorite;zinc;hydrate
PubChem CID159750781
Molecular FormulaH2Cl2O2Zn
Molecular Weight170.31 g/mol
Exact Mass167.87
IUPAC Namechloro hypochlorite;zinc;hydrate
SMILESClOCl.O.[Zn]
InChIInChI=1S/Cl2O.H2O.Zn/c1-3-2;;/h;1H2;
InChIKeyNDPUEPKMJNGUTA-UHFFFAOYSA-N
XLogP0.48
TPSA40.73 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.31
LogP ≤ 50.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze chloro hypochlorite;zinc;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 chloro hypochlorite;zinc;hydrate?
The IUPAC name of chloro hypochlorite;zinc;hydrate (CID 159750781) is chloro hypochlorite;zinc;hydrate.
What is the SMILES notation for chloro hypochlorite;zinc;hydrate?
The canonical SMILES for chloro hypochlorite;zinc;hydrate is ClOCl.O.[Zn].
What is the InChIKey of chloro hypochlorite;zinc;hydrate?
The InChIKey is NDPUEPKMJNGUTA-UHFFFAOYSA-N. The full InChI is InChI=1S/Cl2O.H2O.Zn/c1-3-2;;/h;1H2;.
What are the key properties of chloro hypochlorite;zinc;hydrate?
chloro hypochlorite;zinc;hydrate has a molecular weight of 170.31 g/mol, XLogP of 0.48, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro hypochlorite;zinc;hydrate is sourced from PubChem (CID 159750781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).