1-Dodecylquinolin-1-ium bromide
TL;DR: 1-Dodecylquinolin-1-ium bromide (CAS 14847-86-0) is a chemical compound with molecular formula C21H32BrN and molecular weight 377.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-dodecylquinolin-1-ium bromide
Also Known As: Dodecylchinoliniumbromid, 1-dodecylquinoline Bromide, 1-dodecylquinolin-1-ium bromide, Quinolinium, 1-dodecyl-, bromide
| Molecular Formula | C21H32BrN |
|---|---|
| Molecular Weight | 377.17 g/mol |
| LogP | 3.0522 |
| Topological Polar Surface Area | 3.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 11 |
| Exact Mass | 377.1718 |
| Heavy Atoms | 23 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 14847-86-0 |
|---|---|
| SMILES | CCCCCCCCCCCC[N+]1=CC=CC2=CC=CC=C21.[Br-] |
| InChIKey | KWOPWPWSHCGQMK-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Dodecylquinolin-1-ium bromide (CAS 14847-86-0), with molecular formula C21H32BrN and molecular weight 377.17 g/mol. IUPAC: 1-dodecylquinolin-1-ium bromide.
Chemical Property Profile of 1-Dodecylquinolin-1-ium bromide
Property Insights of 1-Dodecylquinolin-1-ium bromide
The XLogP value of 3.0522 indicates that 1-Dodecylquinolin-1-ium bromide 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-Dodecylquinolin-1-ium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Dodecylquinolin-1-ium bromide 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-Dodecylquinolin-1-ium bromide?
The CAS number of 1-Dodecylquinolin-1-ium bromide is 14847-86-0.
What is the molecular formula of 1-Dodecylquinolin-1-ium bromide?
The molecular formula of 1-Dodecylquinolin-1-ium bromide is C21H32BrN.
What is the molecular weight of 1-Dodecylquinolin-1-ium bromide?
The molecular weight of 1-Dodecylquinolin-1-ium bromide is 377.17 g/mol.
Where can I buy 1-Dodecylquinolin-1-ium bromide?
You can request a quote for 1-Dodecylquinolin-1-ium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Dodecylquinolin-1-ium bromide?
Yes, KEHONG BIO provides custom synthesis services for 1-Dodecylquinolin-1-ium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.