Ethenyl 3-aziridin-1-ylpropanoate
TL;DR: Ethenyl 3-aziridin-1-ylpropanoate (CAS 17586-94-6) is a chemical compound with molecular formula C7H11NO2 and molecular weight 141.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethenyl 3-(aziridin-1-yl)propanoate
Also Known As: ethenyl 3-aziridin-1-ylpropanoate, ethenyl 3-(aziridin-1-yl)propanoate, vinyl 3-(aziridin-1-yl)propanoate, 1-Aziridinepropanoic acid, ethenyl ester
| Molecular Formula | C7H11NO2 |
|---|---|
| Molecular Weight | 141.08 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 29.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 141.07898 |
| Heavy Atoms | 10 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 17586-94-6 |
|---|---|
| SMILES | C=COC(=O)CCN1CC1 |
| InChIKey | DOHNQQJTQUJGEE-UHFFFAOYSA-N |
Product Overview
Ethenyl 3-aziridin-1-ylpropanoate (CAS 17586-94-6), with molecular formula C7H11NO2 and molecular weight 141.08 g/mol. IUPAC: ethenyl 3-(aziridin-1-yl)propanoate.
Chemical Property Profile of Ethenyl 3-aziridin-1-ylpropanoate
Property Insights of Ethenyl 3-aziridin-1-ylpropanoate
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethenyl 3-aziridin-1-ylpropanoate. With a topological polar surface area (TPSA) of 29.3 Ų, Ethenyl 3-aziridin-1-ylpropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethenyl 3-aziridin-1-ylpropanoate has 0 hydrogen bond donor(s) and 3 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 Ethenyl 3-aziridin-1-ylpropanoate?
The CAS number of Ethenyl 3-aziridin-1-ylpropanoate is 17586-94-6.
What is the molecular formula of Ethenyl 3-aziridin-1-ylpropanoate?
The molecular formula of Ethenyl 3-aziridin-1-ylpropanoate is C7H11NO2.
What is the molecular weight of Ethenyl 3-aziridin-1-ylpropanoate?
The molecular weight of Ethenyl 3-aziridin-1-ylpropanoate is 141.08 g/mol.
Where can I buy Ethenyl 3-aziridin-1-ylpropanoate?
You can request a quote for Ethenyl 3-aziridin-1-ylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethenyl 3-aziridin-1-ylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethenyl 3-aziridin-1-ylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.