1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl
TL;DR: 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl (CAS 10031-58-0) is a chemical compound with molecular formula C20H36ClN and molecular weight 325.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-2-methyl-1-(5,5,7,7-tetramethyloctan-2-yl)pyridin-1-ium chloride
Also Known As: 3-Ethyl-6-methyl-1-(1,4,4,6,6-pentamethylheptyl)pyridinium chloride, 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl, Nickel alloy, base, Ni 71-79,Fe 21-29, 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chloride, Pyridinium, 5-ethyl-2-methyl-1-(1,4,4,6,6-pentamethylheptyl)-, chloride
| Molecular Formula | C20H36ClN |
|---|---|
| Molecular Weight | 325.25 g/mol |
| LogP | 2.65 |
| Topological Polar Surface Area | 3.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 325.25363 |
| Heavy Atoms | 22 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 10031-58-0 |
|---|---|
| SMILES | CCC1=C[N+](=C(C=C1)C)C(C)CCC(C)(C)CC(C)(C)C.[Cl-] |
| InChIKey | XZTPBDZTQNLDOX-UHFFFAOYSA-M |
Product Overview
1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl (CAS 10031-58-0), with molecular formula C20H36ClN and molecular weight 325.25 g/mol. IUPAC: 5-ethyl-2-methyl-1-(5,5,7,7-tetramethyloctan-2-yl)pyridin-1-ium chloride.
Chemical Property Profile of 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl
Property Insights of 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl
The XLogP value of 2.65 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl. With a topological polar surface area (TPSA) of 3.9 Ų, 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl 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 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl?
The CAS number of 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl is 10031-58-0.
What is the molecular formula of 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl?
The molecular formula of 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl is C20H36ClN.
What is the molecular weight of 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl?
The molecular weight of 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl is 325.25 g/mol.
Where can I buy 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl?
You can request a quote for 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl?
Yes, KEHONG BIO provides custom synthesis services for 1-(5,5,7,7-Tetramethyl-2-octanyl)-2-methyl-5-ethylpyridinium chl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.