About nitroso nitrate;zirconium
nitroso nitrate;zirconium (PubChem CID 175447009) has the molecular formula N2O4Zr
and a molecular weight of 183.23 g/mol. Its IUPAC name is nitroso nitrate;zirconium.
Molecular Properties
| Compound Name | nitroso nitrate;zirconium |
| PubChem CID | 175447009 |
| Molecular Formula | N2O4Zr |
| Molecular Weight | 183.23 g/mol |
| Exact Mass | 181.89 |
| IUPAC Name | nitroso nitrate;zirconium |
| SMILES | O=NO[N+](=O)[O-].[Zr] |
| InChI | InChI=1S/N2O4.Zr/c3-1-6-2(4)5; |
| InChIKey | SJZWYSBTLGYIOH-UHFFFAOYSA-N |
| XLogP | -0.13 |
| TPSA | 81.80 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 7 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 183.23 |
| LogP ≤ 5 | -0.13 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
|---|
Analyze nitroso nitrate;zirconium 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 nitroso nitrate;zirconium?
The IUPAC name of nitroso nitrate;zirconium (CID 175447009) is nitroso nitrate;zirconium.
What is the SMILES notation for nitroso nitrate;zirconium?
The canonical SMILES for nitroso nitrate;zirconium is O=NO[N+](=O)[O-].[Zr].
What is the InChIKey of nitroso nitrate;zirconium?
The InChIKey is SJZWYSBTLGYIOH-UHFFFAOYSA-N. The full InChI is InChI=1S/N2O4.Zr/c3-1-6-2(4)5;.
What are the key properties of nitroso nitrate;zirconium?
nitroso nitrate;zirconium has a molecular weight of 183.23 g/mol, XLogP of -0.13, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for nitroso nitrate;zirconium is sourced from PubChem (CID 175447009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).