N-2-Chloroethyl-N-methylaziridinium
TL;DR: N-2-Chloroethyl-N-methylaziridinium (CAS 57-54-5) is a chemical compound with molecular formula C5H11ClN+ and molecular weight 120.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethyl)-1-methylaziridin-1-ium
Also Known As: Chlorimine mustard, N-2-Chloroethyl-N-methylaziridinium, 1-(2-Chloroethyl)-1-methylaziridinium, 1-(2-chloroethyl)-1-methylaziridin-1-ium, 1-Methyl-1-(beta-chloroethyl)ethylenimonium
| Molecular Formula | C5H11ClN+ |
|---|---|
| Molecular Weight | 120.06 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 120.058 |
| Heavy Atoms | 7 |
| Complexity | 68.0 |
Chemical Identifiers
| CAS Number | 57-54-5 |
|---|---|
| SMILES | C[N+]1(CC1)CCCl |
| InChIKey | LWMDBBLXXQCZLB-UHFFFAOYSA-N |
Product Overview
N-2-Chloroethyl-N-methylaziridinium (CAS 57-54-5), with molecular formula C5H11ClN+ and molecular weight 120.06 g/mol. IUPAC: 1-(2-chloroethyl)-1-methylaziridin-1-ium.
Chemical Property Profile of N-2-Chloroethyl-N-methylaziridinium
Property Insights of N-2-Chloroethyl-N-methylaziridinium
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-2-Chloroethyl-N-methylaziridinium. With a topological polar surface area (TPSA) of 0.0 Ų, N-2-Chloroethyl-N-methylaziridinium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-2-Chloroethyl-N-methylaziridinium 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
Frequently Asked Questions
What is the CAS number of N-2-Chloroethyl-N-methylaziridinium?
The CAS number of N-2-Chloroethyl-N-methylaziridinium is 57-54-5.
What is the molecular formula of N-2-Chloroethyl-N-methylaziridinium?
The molecular formula of N-2-Chloroethyl-N-methylaziridinium is C5H11ClN+.
What is the molecular weight of N-2-Chloroethyl-N-methylaziridinium?
The molecular weight of N-2-Chloroethyl-N-methylaziridinium is 120.06 g/mol.
Where can I buy N-2-Chloroethyl-N-methylaziridinium?
You can request a quote for N-2-Chloroethyl-N-methylaziridinium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-2-Chloroethyl-N-methylaziridinium?
Yes, KEHONG BIO provides custom synthesis services for N-2-Chloroethyl-N-methylaziridinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.