4-Ethyl-3-methylquinoline
TL;DR: 4-Ethyl-3-methylquinoline (CAS 5659-28-9) is a chemical compound with molecular formula C12H13N and molecular weight 171.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethyl-3-methylquinoline
Also Known As: 4-ethyl-3-methylquinoline, 4-ethyl-3-methyl-quinoline, Quinoline, 4-ethyl-3-methyl-
| Molecular Formula | C12H13N |
|---|---|
| Molecular Weight | 171.10 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 171.1048 |
| Heavy Atoms | 13 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 5659-28-9 |
|---|---|
| SMILES | CCC1=C(C=NC2=CC=CC=C21)C |
| InChIKey | VDHQMGRCMBYXGS-UHFFFAOYSA-N |
Product Overview
4-Ethyl-3-methylquinoline (CAS 5659-28-9), with molecular formula C12H13N and molecular weight 171.10 g/mol. IUPAC: 4-ethyl-3-methylquinoline.
Chemical Property Profile of 4-Ethyl-3-methylquinoline
Property Insights of 4-Ethyl-3-methylquinoline
The XLogP value of 3.4 indicates that 4-Ethyl-3-methylquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.9 Ų, 4-Ethyl-3-methylquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Ethyl-3-methylquinoline 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 4-Ethyl-3-methylquinoline?
The CAS number of 4-Ethyl-3-methylquinoline is 5659-28-9.
What is the molecular formula of 4-Ethyl-3-methylquinoline?
The molecular formula of 4-Ethyl-3-methylquinoline is C12H13N.
What is the molecular weight of 4-Ethyl-3-methylquinoline?
The molecular weight of 4-Ethyl-3-methylquinoline is 171.10 g/mol.
Where can I buy 4-Ethyl-3-methylquinoline?
You can request a quote for 4-Ethyl-3-methylquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Ethyl-3-methylquinoline?
Yes, KEHONG BIO provides custom synthesis services for 4-Ethyl-3-methylquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.