溴化十六烷基吡啶鎓
TL;DR: 溴化十六烷基吡啶鎓 (CAS 140-72-7) is a chemical compound with molecular formula C21H38BrN and molecular weight 383.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
溴化十六烷基吡啶鎓
1-hexadecylpyridin-1-ium bromide
Also Known As: CETYLPYRIDINIUM BROMIDE, Hexadecylpyridinium bromide, 1-Hexadecylpyridinium bromide, Cetapharm, Nitrogenol
| Molecular Formula | C21H38BrN |
|---|---|
| Molecular Weight | 383.22 g/mol |
| LogP | 3.46 |
| Topological Polar Surface Area | 3.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 15 |
| Exact Mass | 383.21875 |
| Heavy Atoms | 23 |
| Complexity | 208.0 |
| Melting Point | 64.5 °C |
| Solubility | Soluble in acetone, ethanol, and chloroform |
Chemical Identifiers
| CAS Number | 140-72-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1.[Br-] |
| InChIKey | DVBJBNKEBPCGSY-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
溴化十六烷基吡啶鎓 (CAS 140-72-7), with molecular formula C21H38BrN and molecular weight 383.22 g/mol. IUPAC: 1-hexadecylpyridin-1-ium bromide.
Chemical Property Profile of 溴化十六烷基吡啶鎓
Property Insights of 溴化十六烷基吡啶鎓
The XLogP value of 3.46 indicates that 溴化十六烷基吡啶鎓 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.9 Ų, 溴化十六烷基吡啶鎓 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 溴化十六烷基吡啶鎓 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 溴化十六烷基吡啶鎓?
The CAS number of 溴化十六烷基吡啶鎓 is 140-72-7.
What is the molecular formula of 溴化十六烷基吡啶鎓?
The molecular formula of 溴化十六烷基吡啶鎓 is C21H38BrN.
What is the molecular weight of 溴化十六烷基吡啶鎓?
The molecular weight of 溴化十六烷基吡啶鎓 is 383.22 g/mol.
Where can I buy 溴化十六烷基吡啶鎓?
You can request a quote for 溴化十六烷基吡啶鎓 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 溴化十六烷基吡啶鎓?
Yes, KEHONG BIO provides custom synthesis services for 溴化十六烷基吡啶鎓 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.