2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium
TL;DR: 2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium (CAS 13603-37-7) is a chemical compound with molecular formula C7H8N2O3 and molecular weight 168.0535 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6-dimethyl-3-nitro-1-oxidopyridin-1-ium
Also Known As: 2,6-Dimethyl-3-nitropyridine 1-oxide, 2,6-dimethyl-3-nitro-1-oxidopyridin-1-ium, 2,6-dimethyl-3-nitropyridin-1-ium-1-olate, Pyridine, 2,6-dimethyl-3-nitro-, 1-oxide, J1.402.452B
Technical Specifications
| Molecular Formula | C7H8N2O3 |
| Molecular Weight | 168.0535 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 71.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 168.0535 Da |
| Heavy Atoms | 12 |
| Complexity | 180.0 |
| SMILES | CC1=[N+](C(=C(C=C1)[N+](=O)[O-])C)[O-] |
| InChIKey | DIQLHBUSZGIRNX-UHFFFAOYSA-N |
Chemical Property Profile of 2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium
Property Insights of 2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium. The TPSA of 71.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium. Following Lipinski's Rule of Five, 2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium 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
What is the CAS number of 2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium?
The CAS number of 2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium is 13603-37-7.
What is the molecular formula of 2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium?
The molecular formula of 2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium is C7H8N2O3.
What is the molecular weight of 2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium?
The molecular weight of 2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium is 168.0535 g/mol.
Where can I buy 2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium?
You can request a quote for 2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium?
Yes, CoreyChem provides custom synthesis services for 2,6-Dimethyl-3-nitro-1-oxidopyridin-1-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.