2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride
TL;DR: 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride (CAS 63977-49-1) is a chemical compound with molecular formula C6H14Cl3N and molecular weight 205.01918 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(2-chloroethyl)-dimethylazanium chloride
Also Known As: TL 379, Bis(2-chloroethyl)dimethylammonium chloride, Ethanaminium,N-dimethyl-, chloride, bis(2-chloroethyl)-dimethylazanium,chloride, Dimethyl-bis(beta-chloroethyl)ammonium chloride
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H14Cl3N |
| Molecular Weight | 205.01918 g/mol |
| XLogP | -1.46 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 205.01918 Da |
| Heavy Atoms | 10 |
| Complexity | 65.0 |
| SMILES | C[N+](C)(CCCl)CCCl.[Cl-] |
| InChIKey | MGFVNWXRFBPCJJ-UHFFFAOYSA-M |
Chemical Property Profile of 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride
Property Insights of 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride
The XLogP value of -1.46 indicates that 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride 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
What is the CAS number of 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride?
The CAS number of 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride is 63977-49-1.
What is the molecular formula of 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride?
The molecular formula of 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride is C6H14Cl3N.
What is the molecular weight of 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride?
The molecular weight of 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride is 205.01918 g/mol.
Where can I buy 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride?
You can request a quote for 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride?
Yes, CoreyChem provides custom synthesis services for 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.