zinc;dichloride;hexahydrate

H12Cl2O6Zn — CID 173294379

IUPACzinc;dichloride;hexahydrate
SMILESO.O.O.O.O.O.[Cl-].[Cl-].[Zn+2]
InChIInChI=1S/2ClH.6H2O.Zn/h2*1H;6*1H2;/q;;;;;;;;+2/p-2
InChIKeyICXVJVVYSULERR-UHFFFAOYSA-L
MW244.39 g/mol
LogP-10.94
Rot. Bonds

About zinc;dichloride;hexahydrate

zinc;dichloride;hexahydrate (PubChem CID 173294379) has the molecular formula H12Cl2O6Zn and a molecular weight of 244.39 g/mol. Its IUPAC name is zinc;dichloride;hexahydrate.

Molecular Properties

Compound Namezinc;dichloride;hexahydrate
PubChem CID173294379
Molecular FormulaH12Cl2O6Zn
Molecular Weight244.39 g/mol
Exact Mass241.93
IUPAC Namezinc;dichloride;hexahydrate
SMILESO.O.O.O.O.O.[Cl-].[Cl-].[Zn+2]
InChIInChI=1S/2ClH.6H2O.Zn/h2*1H;6*1H2;/q;;;;;;;;+2/p-2
InChIKeyICXVJVVYSULERR-UHFFFAOYSA-L
XLogP-10.94
TPSA189.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.39
LogP ≤ 5-10.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 zinc;dichloride;hexahydrate?
The IUPAC name of zinc;dichloride;hexahydrate (CID 173294379) is zinc;dichloride;hexahydrate.
What is the SMILES notation for zinc;dichloride;hexahydrate?
The canonical SMILES for zinc;dichloride;hexahydrate is O.O.O.O.O.O.[Cl-].[Cl-].[Zn+2].
What is the InChIKey of zinc;dichloride;hexahydrate?
The InChIKey is ICXVJVVYSULERR-UHFFFAOYSA-L. The full InChI is InChI=1S/2ClH.6H2O.Zn/h2*1H;6*1H2;/q;;;;;;;;+2/p-2.
What are the key properties of zinc;dichloride;hexahydrate?
zinc;dichloride;hexahydrate has a molecular weight of 244.39 g/mol, XLogP of -10.94, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;dichloride;hexahydrate is sourced from PubChem (CID 173294379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).