Pyridinium, 1-octyl-, bromide (1:1)
TL;DR: Pyridinium, 1-octyl-, bromide (1:1) (CAS 2534-66-9) is a chemical compound with molecular formula C13H22BrN and molecular weight 271.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-octylpyridin-1-ium bromide
Also Known As: n-octylpyridinium bromide, 1-Octylpyridinium bromide, Octylpyridinium bromide, 1-octylpyridinium bromid, 1-Octylpyridiniumbromide
| Molecular Formula | C13H22BrN |
|---|---|
| Molecular Weight | 271.09 g/mol |
| LogP | 0.34 |
| Topological Polar Surface Area | 3.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 271.09357 |
| Heavy Atoms | 15 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 2534-66-9 |
|---|---|
| SMILES | CCCCCCCC[N+]1=CC=CC=C1.[Br-] |
| InChIKey | LNKPCMOUFKLBCM-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyridinium, 1-octyl-, bromide (1:1) (CAS 2534-66-9), with molecular formula C13H22BrN and molecular weight 271.09 g/mol. IUPAC: 1-octylpyridin-1-ium bromide.
Chemical Property Profile of Pyridinium, 1-octyl-, bromide (1:1)
Property Insights of Pyridinium, 1-octyl-, bromide (1:1)
The XLogP value of 0.34 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridinium, 1-octyl-, bromide (1:1). With a topological polar surface area (TPSA) of 3.9 Ų, Pyridinium, 1-octyl-, bromide (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridinium, 1-octyl-, bromide (1:1) 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 Pyridinium, 1-octyl-, bromide (1:1)?
The CAS number of Pyridinium, 1-octyl-, bromide (1:1) is 2534-66-9.
What is the molecular formula of Pyridinium, 1-octyl-, bromide (1:1)?
The molecular formula of Pyridinium, 1-octyl-, bromide (1:1) is C13H22BrN.
What is the molecular weight of Pyridinium, 1-octyl-, bromide (1:1)?
The molecular weight of Pyridinium, 1-octyl-, bromide (1:1) is 271.09 g/mol.
Where can I buy Pyridinium, 1-octyl-, bromide (1:1)?
You can request a quote for Pyridinium, 1-octyl-, bromide (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridinium, 1-octyl-, bromide (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Pyridinium, 1-octyl-, bromide (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.