5-Ethyl-2-methylpyridine 1-oxide
TL;DR: 5-Ethyl-2-methylpyridine 1-oxide (CAS 768-44-5) is a chemical compound with molecular formula C8H11NO and molecular weight 137.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-2-methyl-1-oxidopyridin-1-ium
Also Known As: 5-Ethyl-2-methylpyridine 1-oxide, Pyridine, 1-oxide, 2-Picoline, 1-oxide, 2-Picoline, 5-ethyl-, 1-oxide, 5-Ethyl-2-methylpyridine N-oxide
| Molecular Formula | C8H11NO |
|---|---|
| Molecular Weight | 137.08 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 25.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 137.08406 |
| Heavy Atoms | 10 |
| Complexity | 105.0 |
Chemical Identifiers
| CAS Number | 768-44-5 |
|---|---|
| SMILES | CCC1=C[N+](=C(C=C1)C)[O-] |
| InChIKey | NUDXKJOCNHFUEZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Ethyl-2-methylpyridine 1-oxide (CAS 768-44-5), with molecular formula C8H11NO and molecular weight 137.08 g/mol. IUPAC: 5-ethyl-2-methyl-1-oxidopyridin-1-ium.
Chemical Property Profile of 5-Ethyl-2-methylpyridine 1-oxide
Property Insights of 5-Ethyl-2-methylpyridine 1-oxide
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethyl-2-methylpyridine 1-oxide. With a topological polar surface area (TPSA) of 25.5 Ų, 5-Ethyl-2-methylpyridine 1-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethyl-2-methylpyridine 1-oxide has 0 hydrogen bond donor(s) and 1 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-methylpyridine 1-oxide?
The CAS number of 5-Ethyl-2-methylpyridine 1-oxide is 768-44-5.
What is the molecular formula of 5-Ethyl-2-methylpyridine 1-oxide?
The molecular formula of 5-Ethyl-2-methylpyridine 1-oxide is C8H11NO.
What is the molecular weight of 5-Ethyl-2-methylpyridine 1-oxide?
The molecular weight of 5-Ethyl-2-methylpyridine 1-oxide is 137.08 g/mol.
Where can I buy 5-Ethyl-2-methylpyridine 1-oxide?
You can request a quote for 5-Ethyl-2-methylpyridine 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-methylpyridine 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethyl-2-methylpyridine 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.