1-Octylpyridinium
TL;DR: 1-Octylpyridinium (CAS 34958-55-9) is a chemical compound with molecular formula C13H22N+ and molecular weight 192.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-octylpyridin-1-ium
Also Known As: 1-octylpyridinium, 1-octylpyridine, 1-octylpyridin-1-ium, n-octylpyridinium, N-1-Octylpyridinium
| Molecular Formula | C13H22N+ |
|---|---|
| Molecular Weight | 192.18 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 3.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 7 |
| Exact Mass | 192.17523 |
| Heavy Atoms | 14 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 34958-55-9 |
|---|---|
| SMILES | CCCCCCCC[N+]1=CC=CC=C1 |
| InChIKey | XDEQOBPALZZTCA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Octylpyridinium (CAS 34958-55-9), with molecular formula C13H22N+ and molecular weight 192.18 g/mol. IUPAC: 1-octylpyridin-1-ium.
Chemical Property Profile of 1-Octylpyridinium
Property Insights of 1-Octylpyridinium
The XLogP value of 4.3 indicates that 1-Octylpyridinium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.9 Ų, 1-Octylpyridinium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Octylpyridinium has 0 hydrogen bond donor(s) and 0 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-Octylpyridinium?
The CAS number of 1-Octylpyridinium is 34958-55-9.
What is the molecular formula of 1-Octylpyridinium?
The molecular formula of 1-Octylpyridinium is C13H22N+.
What is the molecular weight of 1-Octylpyridinium?
The molecular weight of 1-Octylpyridinium is 192.18 g/mol.
Where can I buy 1-Octylpyridinium?
You can request a quote for 1-Octylpyridinium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Octylpyridinium?
Yes, KEHONG BIO provides custom synthesis services for 1-Octylpyridinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.