5-Ethyl-2-methyl-4-nitropyridine 1-oxide
TL;DR: 5-Ethyl-2-methyl-4-nitropyridine 1-oxide (CAS 1131-20-0) is a chemical compound with molecular formula C8H10N2O3 and molecular weight 182.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-2-methyl-4-nitro-1-oxidopyridin-1-ium
Also Known As: 5-Ethyl-2-methyl-4-nitropyridine 1-oxide, 5-ethyl-2-methyl-4-nitro-1-oxidopyridin-1-ium, 4-nitro-5-ethyl-2-methylpyridine n oxide, 2246AA, 3-ethyl-6-methyl-4-nitro-6H-pyridine 1-oxide
| Molecular Formula | C8H10N2O3 |
|---|---|
| Molecular Weight | 182.07 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 71.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 182.06914 |
| Heavy Atoms | 13 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 1131-20-0 |
|---|---|
| SMILES | CCC1=C(C=C([N+](=C1)[O-])C)[N+](=O)[O-] |
| InChIKey | DANDYWNNFZVYIE-UHFFFAOYSA-N |
Product Overview
5-Ethyl-2-methyl-4-nitropyridine 1-oxide (CAS 1131-20-0), with molecular formula C8H10N2O3 and molecular weight 182.07 g/mol. IUPAC: 5-ethyl-2-methyl-4-nitro-1-oxidopyridin-1-ium.
Chemical Property Profile of 5-Ethyl-2-methyl-4-nitropyridine 1-oxide
Property Insights of 5-Ethyl-2-methyl-4-nitropyridine 1-oxide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethyl-2-methyl-4-nitropyridine 1-oxide. The TPSA of 71.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Ethyl-2-methyl-4-nitropyridine 1-oxide. Following Lipinski's Rule of Five, 5-Ethyl-2-methyl-4-nitropyridine 1-oxide 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 5-Ethyl-2-methyl-4-nitropyridine 1-oxide?
The CAS number of 5-Ethyl-2-methyl-4-nitropyridine 1-oxide is 1131-20-0.
What is the molecular formula of 5-Ethyl-2-methyl-4-nitropyridine 1-oxide?
The molecular formula of 5-Ethyl-2-methyl-4-nitropyridine 1-oxide is C8H10N2O3.
What is the molecular weight of 5-Ethyl-2-methyl-4-nitropyridine 1-oxide?
The molecular weight of 5-Ethyl-2-methyl-4-nitropyridine 1-oxide is 182.07 g/mol.
Where can I buy 5-Ethyl-2-methyl-4-nitropyridine 1-oxide?
You can request a quote for 5-Ethyl-2-methyl-4-nitropyridine 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethyl-2-methyl-4-nitropyridine 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethyl-2-methyl-4-nitropyridine 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.