About phenazin-1-ol
phenazin-1-ol (PubChem CID 135412648) has the molecular formula C12H8N2O
and a molecular weight of 196.21 g/mol. Its IUPAC name is phenazin-1-ol.
Molecular Properties
| Compound Name | phenazin-1-ol |
| PubChem CID | 135412648 |
| Molecular Formula | C12H8N2O |
| Molecular Weight | 196.21 g/mol |
| Exact Mass | 196.06 |
| IUPAC Name | phenazin-1-ol |
| SMILES | Oc1cccc2nc3ccccc3nc12 |
| InChI | InChI=1S/C12H8N2O/c15-11-7-3-6-10-12(11)14-9-5-2-1-4-8(9)13-10/h1-7,15H |
| InChIKey | SVRNCBGWUMMBQB-UHFFFAOYSA-N |
| XLogP | 2.49 |
| TPSA | 46.01 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 196.21 |
| LogP ≤ 5 | 2.49 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of phenazin-1-ol?
The IUPAC name of phenazin-1-ol (CID 135412648) is phenazin-1-ol.
What is the SMILES notation for phenazin-1-ol?
The canonical SMILES for phenazin-1-ol is Oc1cccc2nc3ccccc3nc12.
What is the InChIKey of phenazin-1-ol?
The InChIKey is SVRNCBGWUMMBQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N2O/c15-11-7-3-6-10-12(11)14-9-5-2-1-4-8(9)13-10/h1-7,15H.
What are the key properties of phenazin-1-ol?
phenazin-1-ol has a molecular weight of 196.21 g/mol, XLogP of 2.49, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenazin-1-ol is sourced from PubChem (CID 135412648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).