Pyridazine, 4-nitro-, 1-oxide
TL;DR: Pyridazine, 4-nitro-, 1-oxide (CAS 28147-45-7) is a chemical compound with molecular formula C4H3N3O3 and molecular weight 141.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-1-oxidopyridazin-1-ium
Also Known As: 4-Nitropyridazine 1-oxide, Pyridazine, 4-nitro-, 1-oxide, 4-nitropyridazine-1-oxide, 4-nitro-1-oxidopyridazin-1-ium, 4-Nitro-1-oxo-1lambda~5~-pyridazine
| Molecular Formula | C4H3N3O3 |
|---|---|
| Molecular Weight | 141.02 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 141.01744 |
| Heavy Atoms | 10 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 28147-45-7 |
|---|---|
| SMILES | C1=C[N+](=NC=C1[N+](=O)[O-])[O-] |
| InChIKey | DLPVMLNSRZSOAK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyridazine, 4-nitro-, 1-oxide (CAS 28147-45-7), with molecular formula C4H3N3O3 and molecular weight 141.02 g/mol. IUPAC: 4-nitro-1-oxidopyridazin-1-ium.
Chemical Property Profile of Pyridazine, 4-nitro-, 1-oxide
Property Insights of Pyridazine, 4-nitro-, 1-oxide
The XLogP value of -0.7 indicates that Pyridazine, 4-nitro-, 1-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyridazine, 4-nitro-, 1-oxide. Following Lipinski's Rule of Five, Pyridazine, 4-nitro-, 1-oxide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyridazine, 4-nitro-, 1-oxide?
The CAS number of Pyridazine, 4-nitro-, 1-oxide is 28147-45-7.
What is the molecular formula of Pyridazine, 4-nitro-, 1-oxide?
The molecular formula of Pyridazine, 4-nitro-, 1-oxide is C4H3N3O3.
What is the molecular weight of Pyridazine, 4-nitro-, 1-oxide?
The molecular weight of Pyridazine, 4-nitro-, 1-oxide is 141.02 g/mol.
Where can I buy Pyridazine, 4-nitro-, 1-oxide?
You can request a quote for Pyridazine, 4-nitro-, 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridazine, 4-nitro-, 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for Pyridazine, 4-nitro-, 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.