Pyridazine 1-oxide
TL;DR: Pyridazine 1-oxide (CAS 1457-42-7) is a chemical compound with molecular formula C1=CC=[N+](N=C1)[O-] and molecular weight 96.032364 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-oxidopyridazin-1-ium
Also Known As: Pyridazine N-oxide, Pyridazine 1-oxide, 1-oxidopyridazin-1-ium, Pyridazine, 1-oxide, Pyridazinen-oxide
Application Areas
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C1=CC=[N+](N=C1)[O-] |
| Molecular Weight | 96.032364 g/mol |
| XLogP | -0.6 |
| Topological Polar Surface Area (TPSA) | 38.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 96.032364 Da |
| Heavy Atoms | 7 |
| Complexity | 57.0 |
| SMILES | C1=CC=[N+](N=C1)[O-] |
| InChIKey | GAJBWMUZVXJIBO-UHFFFAOYSA-N |
Chemical Property Profile of Pyridazine 1-oxide
Property Insights of Pyridazine 1-oxide
The XLogP value of -0.6 indicates that Pyridazine 1-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 38.4 Ų, Pyridazine 1-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridazine 1-oxide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Pyridazine 1-oxide?
The CAS number of Pyridazine 1-oxide is 1457-42-7.
What is the molecular formula of Pyridazine 1-oxide?
The molecular formula of Pyridazine 1-oxide is C1=CC=[N+](N=C1)[O-].
What is the molecular weight of Pyridazine 1-oxide?
The molecular weight of Pyridazine 1-oxide is 96.032364 g/mol.
Where can I buy Pyridazine 1-oxide?
You can request a quote for Pyridazine 1-oxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pyridazine 1-oxide?
Yes, CoreyChem provides custom synthesis services for Pyridazine 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.