4-硝基吡啶-N-氧化物
TL;DR: 4-硝基吡啶-N-氧化物 (CAS 1124-33-0) is a chemical compound with molecular formula C5H4N2O3 and molecular weight 140.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-硝基吡啶-N-氧化物
4-nitro-1-oxidopyridin-1-ium
Also Known As: 4-Nitropyridine N-oxide, 4-Nitropyridine 1-oxide, 4-Nitropyridine-N-oxide, 4-Nitropyridine-1-oxide, 4-Nitropyridine oxide
| Molecular Formula | C5H4N2O3 |
|---|---|
| Molecular Weight | 140.02 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 71.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.02219 |
| Heavy Atoms | 10 |
| Complexity | 125.0 |
| Melting Point | 160.5 °C |
| Vapor Pressure | 0.000594 [mmHg] |
Chemical Identifiers
| CAS Number | 1124-33-0 |
|---|---|
| SMILES | C1=C[N+](=CC=C1[N+](=O)[O-])[O-] |
| InChIKey | RXKNNAKAVAHBNK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-硝基吡啶-N-氧化物 (CAS 1124-33-0), with molecular formula C5H4N2O3 and molecular weight 140.02 g/mol. IUPAC: 4-nitro-1-oxidopyridin-1-ium.
Chemical Property Profile of 4-硝基吡啶-N-氧化物
Property Insights of 4-硝基吡啶-N-氧化物
The XLogP value of -0.6 indicates that 4-硝基吡啶-N-氧化物 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 71.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-硝基吡啶-N-氧化物. Following Lipinski's Rule of Five, 4-硝基吡啶-N-氧化物 has 0 hydrogen bond donor(s) and 3 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 4-硝基吡啶-N-氧化物?
The CAS number of 4-硝基吡啶-N-氧化物 is 1124-33-0.
What is the molecular formula of 4-硝基吡啶-N-氧化物?
The molecular formula of 4-硝基吡啶-N-氧化物 is C5H4N2O3.
What is the molecular weight of 4-硝基吡啶-N-氧化物?
The molecular weight of 4-硝基吡啶-N-氧化物 is 140.02 g/mol.
Where can I buy 4-硝基吡啶-N-氧化物?
You can request a quote for 4-硝基吡啶-N-氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-硝基吡啶-N-氧化物?
Yes, KEHONG BIO provides custom synthesis services for 4-硝基吡啶-N-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.