About zinc;nickel(2+);titanium;tetrahydroxide
zinc;nickel(2+);titanium;tetrahydroxide (PubChem CID 173231623) has the molecular formula H4NiO4TiZn
and a molecular weight of 239.98 g/mol. Its IUPAC name is zinc;nickel(2+);titanium;tetrahydroxide.
Molecular Properties
| Compound Name | zinc;nickel(2+);titanium;tetrahydroxide |
|---|
| PubChem CID | 173231623 |
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| Molecular Formula | H4NiO4TiZn |
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| Molecular Weight | 239.98 g/mol |
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| Exact Mass | 237.82 |
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| IUPAC Name | zinc;nickel(2+);titanium;tetrahydroxide |
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| SMILES | [Ni+2].[OH-].[OH-].[OH-].[OH-].[Ti].[Zn+2] |
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| InChI | InChI=1S/Ni.4H2O.Ti.Zn/h;4*1H2;;/q+2;;;;;;+2/p-4 |
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| InChIKey | OZMPOKZOASWKAU-UHFFFAOYSA-J |
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| XLogP | -0.71 |
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| TPSA | 120.00 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | 4 |
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| Rotatable Bonds | |
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| Heavy Atoms | 7 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 239.98 |
| LogP ≤ 5 | -0.71 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
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;nickel(2+);titanium;tetrahydroxide?
The IUPAC name of zinc;nickel(2+);titanium;tetrahydroxide (CID 173231623) is zinc;nickel(2+);titanium;tetrahydroxide.
What is the SMILES notation for zinc;nickel(2+);titanium;tetrahydroxide?
The canonical SMILES for zinc;nickel(2+);titanium;tetrahydroxide is [Ni+2].[OH-].[OH-].[OH-].[OH-].[Ti].[Zn+2].
What is the InChIKey of zinc;nickel(2+);titanium;tetrahydroxide?
The InChIKey is OZMPOKZOASWKAU-UHFFFAOYSA-J. The full InChI is InChI=1S/Ni.4H2O.Ti.Zn/h;4*1H2;;/q+2;;;;;;+2/p-4.
What are the key properties of zinc;nickel(2+);titanium;tetrahydroxide?
zinc;nickel(2+);titanium;tetrahydroxide has a molecular weight of 239.98 g/mol, XLogP of -0.71, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;nickel(2+);titanium;tetrahydroxide is sourced from PubChem (CID 173231623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).