Acetylethylenimine
TL;DR: Acetylethylenimine (CAS 460-07-1) is a chemical compound with molecular formula C4H7NO and molecular weight 85.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(aziridin-1-yl)ethanone
Also Known As: 1-Acetylaziridine, N-Acetylethyleneimine, Acetylethylenimine, N-Acetylaziridine, N-Acetylethylenimine
| Molecular Formula | C4H7NO |
|---|---|
| Molecular Weight | 85.05 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 20.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 85.052765 |
| Heavy Atoms | 6 |
| Complexity | 75.0 |
Chemical Identifiers
| CAS Number | 460-07-1 |
|---|---|
| SMILES | CC(=O)N1CC1 |
| InChIKey | OTIXUSNHAKOJBX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acetylethylenimine (CAS 460-07-1), with molecular formula C4H7NO and molecular weight 85.05 g/mol. IUPAC: 1-(aziridin-1-yl)ethanone.
Chemical Property Profile of Acetylethylenimine
Property Insights of Acetylethylenimine
The XLogP value of -0.5 indicates that Acetylethylenimine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 20.1 Ų, Acetylethylenimine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetylethylenimine 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 Acetylethylenimine?
The CAS number of Acetylethylenimine is 460-07-1.
What is the molecular formula of Acetylethylenimine?
The molecular formula of Acetylethylenimine is C4H7NO.
What is the molecular weight of Acetylethylenimine?
The molecular weight of Acetylethylenimine is 85.05 g/mol.
Where can I buy Acetylethylenimine?
You can request a quote for Acetylethylenimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetylethylenimine?
Yes, KEHONG BIO provides custom synthesis services for Acetylethylenimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.