About hexaoxidanium;nickel(2+)
hexaoxidanium;nickel(2+) (PubChem CID 5242104) has the molecular formula H18NiO6+8
and a molecular weight of 172.83 g/mol. Its IUPAC name is hexaoxidanium;nickel(2+).
Molecular Properties
| Compound Name | hexaoxidanium;nickel(2+) |
| PubChem CID | 5242104 |
| Molecular Formula | H18NiO6+8 |
| Molecular Weight | 172.83 g/mol |
| Exact Mass | 172.04 |
| IUPAC Name | hexaoxidanium;nickel(2+) |
| SMILES | [Ni+2].[OH3+].[OH3+].[OH3+].[OH3+].[OH3+].[OH3+] |
| InChI | InChI=1S/Ni.6H2O/h;6*1H2/q+2;;;;;;/p+6 |
| InChIKey | VMNGQVOJJXRBAC-UHFFFAOYSA-T |
| XLogP | -5.53 |
| TPSA | 198.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | |
| Heavy Atoms | 7 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 172.83 |
| LogP ≤ 5 | -5.53 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'} |
|---|
Analyze hexaoxidanium;nickel(2+) 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 hexaoxidanium;nickel(2+)?
The IUPAC name of hexaoxidanium;nickel(2+) (CID 5242104) is hexaoxidanium;nickel(2+).
What is the SMILES notation for hexaoxidanium;nickel(2+)?
The canonical SMILES for hexaoxidanium;nickel(2+) is [Ni+2].[OH3+].[OH3+].[OH3+].[OH3+].[OH3+].[OH3+].
What is the InChIKey of hexaoxidanium;nickel(2+)?
The InChIKey is VMNGQVOJJXRBAC-UHFFFAOYSA-T. The full InChI is InChI=1S/Ni.6H2O/h;6*1H2/q+2;;;;;;/p+6.
What are the key properties of hexaoxidanium;nickel(2+)?
hexaoxidanium;nickel(2+) has a molecular weight of 172.83 g/mol, XLogP of -5.53, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hexaoxidanium;nickel(2+) is sourced from PubChem (CID 5242104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).