N-(2-Chloroethyl)aziridine
TL;DR: N-(2-Chloroethyl)aziridine (CAS 694-03-1) is a chemical compound with molecular formula C4H8ClN and molecular weight 105.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethyl)aziridine
Also Known As: 1-(2-Chloroethyl)aziridine, N-2-Chloroethylaziridine, chloroethylaziridine, N-(2-Chloroethyl)aziridine, 1-(2-chloro-ethyl)-aziridine
| Molecular Formula | C4H8ClN |
|---|---|
| Molecular Weight | 105.03 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 3.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 105.03453 |
| Heavy Atoms | 6 |
| Complexity | 42.0 |
Chemical Identifiers
| CAS Number | 694-03-1 |
|---|---|
| SMILES | C1CN1CCCl |
| InChIKey | YZXPJVLVVIQNPF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2-Chloroethyl)aziridine (CAS 694-03-1), with molecular formula C4H8ClN and molecular weight 105.03 g/mol. IUPAC: 1-(2-chloroethyl)aziridine.
Chemical Property Profile of N-(2-Chloroethyl)aziridine
Property Insights of N-(2-Chloroethyl)aziridine
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Chloroethyl)aziridine. With a topological polar surface area (TPSA) of 3.0 Ų, N-(2-Chloroethyl)aziridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Chloroethyl)aziridine 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
Frequently Asked Questions
What is the CAS number of N-(2-Chloroethyl)aziridine?
The CAS number of N-(2-Chloroethyl)aziridine is 694-03-1.
What is the molecular formula of N-(2-Chloroethyl)aziridine?
The molecular formula of N-(2-Chloroethyl)aziridine is C4H8ClN.
What is the molecular weight of N-(2-Chloroethyl)aziridine?
The molecular weight of N-(2-Chloroethyl)aziridine is 105.03 g/mol.
Where can I buy N-(2-Chloroethyl)aziridine?
You can request a quote for N-(2-Chloroethyl)aziridine 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)aziridine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Chloroethyl)aziridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.