Bretylium
TL;DR: Bretylium (CAS 59-41-6) is a chemical compound with molecular formula C11H17BrN+ and molecular weight 242.05444 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-bromophenyl)methyl-ethyl-dimethylazanium
Also Known As: Bretylium, Bretylum, Bretylium tosylate, Bretylate, Bretylan
Application Areas
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H17BrN+ |
| Molecular Weight | 242.05444 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.05444 Da |
| Heavy Atoms | 13 |
| Complexity | 156.0 |
| Melting Point | 238 |
| Solubility | Freely soluble |
| SMILES | CC[N+](C)(C)CC1=CC=CC=C1Br |
| InChIKey | AAQOQKQBGPPFNS-UHFFFAOYSA-N |
Product Description
Applications: Bretylium is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A pharmaceutical intermediate supplied by CoreyChem, Bretylium (CAS 59-41-6) has the molecular formula C11H17BrN+ and a molecular weight of 242.05 g/mol. Reported properties include a solubility: Freely soluble. Synonyms include Bretylium and Bretylum.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Bretylium
Property Insights of Bretylium
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bretylium. With a topological polar surface area (TPSA) of 0.0 Ų, Bretylium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bretylium 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
What is the CAS number of Bretylium?
The CAS number of Bretylium is 59-41-6.
What is the molecular formula of Bretylium?
The molecular formula of Bretylium is C11H17BrN+.
What is the molecular weight of Bretylium?
The molecular weight of Bretylium is 242.05444 g/mol.
What are the applications of Bretylium?
Bretylium is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton...
Where can I buy Bretylium?
You can request a quote for Bretylium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bretylium?
Yes, CoreyChem provides custom synthesis services for Bretylium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.