Metalkonium Chloride
TL;DR: Metalkonium Chloride (CAS 100-95-8) is a chemical compound with molecular formula C23H41ClN2O and molecular weight 396.29074 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl-[2-(dodecylamino)-2-oxoethyl]-dimethylazanium chloride
Also Known As: Metalkonium chloride, Straminol, Hydramon, Dodecarbonium, Nopcoccide
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C23H41ClN2O |
| Molecular Weight | 396.29074 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 396.29074 Da |
| Heavy Atoms | 27 |
| Complexity | 348.0 |
| SMILES | CCCCCCCCCCCCNC(=O)C[N+](C)(C)CC1=CC=CC=C1.[Cl-] |
| InChIKey | COLOBWZNRYGBRU-UHFFFAOYSA-N |
Product Description
Applications: Metalkonium Chloride is used in pharmaceutical synthesis routes and API production, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Metalkonium Chloride (CAS 100-95-8) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Metalkonium Chloride is a pharmaceutical intermediate identified by CAS number 100-95-8 and the molecular formula C23H41ClN2O and a molecular weight of 396.29 g/mol. It is also known as Metalkonium chloride and Straminol.
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 Metalkonium Chloride
Property Insights of Metalkonium Chloride
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Metalkonium Chloride. With a topological polar surface area (TPSA) of 29.1 Ų, Metalkonium Chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Metalkonium Chloride has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Metalkonium Chloride?
The CAS number of Metalkonium Chloride is 100-95-8.
What is the molecular formula of Metalkonium Chloride?
The molecular formula of Metalkonium Chloride is C23H41ClN2O.
What is the molecular weight of Metalkonium Chloride?
The molecular weight of Metalkonium Chloride is 396.29074 g/mol.
What are the applications of Metalkonium Chloride?
Metalkonium Chloride is used in pharmaceutical synthesis routes and API production, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Metalkonium Chloride (CAS 100-95-8) with...
Where can I buy Metalkonium Chloride?
You can request a quote for Metalkonium Chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Metalkonium Chloride?
Yes, CoreyChem provides custom synthesis services for Metalkonium Chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.