3-Ethyl-4-methylpyridine
TL;DR: 3-Ethyl-4-methylpyridine (CAS 529-21-5) is a chemical compound with molecular formula C8H11N and molecular weight 121.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-4-methylpyridine
Also Known As: 3-Ethyl-4-methylpyridine, 3-Ethyl-4-picoline, beta-Collidine, b-collidine, .beta.-Collidine
| Molecular Formula | C8H11N |
|---|---|
| Molecular Weight | 121.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 121.08915 |
| Heavy Atoms | 9 |
| Complexity | 80.0 |
Chemical Identifiers
| CAS Number | 529-21-5 |
|---|---|
| SMILES | CCC1=C(C=CN=C1)C |
| InChIKey | JDQNYWYMNFRKNQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Ethyl-4-methylpyridine (CAS 529-21-5), with molecular formula C8H11N and molecular weight 121.09 g/mol. IUPAC: 3-ethyl-4-methylpyridine.
Chemical Property Profile of 3-Ethyl-4-methylpyridine
Property Insights of 3-Ethyl-4-methylpyridine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Ethyl-4-methylpyridine. With a topological polar surface area (TPSA) of 12.9 Ų, 3-Ethyl-4-methylpyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethyl-4-methylpyridine 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 3-Ethyl-4-methylpyridine?
The CAS number of 3-Ethyl-4-methylpyridine is 529-21-5.
What is the molecular formula of 3-Ethyl-4-methylpyridine?
The molecular formula of 3-Ethyl-4-methylpyridine is C8H11N.
What is the molecular weight of 3-Ethyl-4-methylpyridine?
The molecular weight of 3-Ethyl-4-methylpyridine is 121.09 g/mol.
Where can I buy 3-Ethyl-4-methylpyridine?
You can request a quote for 3-Ethyl-4-methylpyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethyl-4-methylpyridine?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethyl-4-methylpyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.