Benzododecinium
TL;DR: Benzododecinium (CAS 10328-35-5) is a chemical compound with molecular formula C21H38N+ and molecular weight 304.3004 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl-dodecyl-dimethylazanium
Also Known As: Benzododecinium, Ajatin, Benzalkonium, Benzododecinium ion, Sterinol
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C21H38N+ |
| Molecular Weight | 304.3004 g/mol |
| XLogP | 7.4 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 13 |
| Exact Mass | 304.3004 Da |
| Heavy Atoms | 22 |
| Complexity | 240.0 |
| SMILES | CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1 |
| InChIKey | CYDRXTMLKJDRQH-UHFFFAOYSA-N |
Product Description
Applications: Benzododecinium is used in pharmaceutical synthesis routes and API production, as well as complex organic molecule assembly across discovery and process chemistry. 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).
Benzododecinium is a pharmaceutical intermediate identified by CAS number 10328-35-5 and the molecular formula C21H38N+ and a molecular weight of 304.3 g/mol. Synonyms include Benzododecinium and Ajatin.
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 Benzododecinium
Property Insights of Benzododecinium
The XLogP value of 7.4 indicates that Benzododecinium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzododecinium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzododecinium has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Benzododecinium?
The CAS number of Benzododecinium is 10328-35-5.
What is the molecular formula of Benzododecinium?
The molecular formula of Benzododecinium is C21H38N+.
What is the molecular weight of Benzododecinium?
The molecular weight of Benzododecinium is 304.3004 g/mol.
What are the applications of Benzododecinium?
Benzododecinium is used in pharmaceutical synthesis routes and API production, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Benzododecinium?
You can request a quote for Benzododecinium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzododecinium?
Yes, CoreyChem provides custom synthesis services for Benzododecinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.