Ethyl 3-(ethylamino)acrylate
TL;DR: Ethyl 3-(ethylamino)acrylate (CAS 104599-70-4) is a chemical compound with molecular formula C7H13NO2 and molecular weight 143.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (E)-3-(ethylamino)prop-2-enoate
Also Known As: HefD@NADfU]ZfjAAP, Ethyl 3-(ethylamino)acrylate, beta-Ethylaminoacrylicacidethylester, Ethyl (E)-3-(ethylamino)acrylate, ethyl 3-(ethylamino)-2-propenoate
| Molecular Formula | C7H13NO2 |
|---|---|
| Molecular Weight | 143.09 g/mol |
| LogP | 0.6727 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 143.09464 |
| Heavy Atoms | 10 |
| Complexity | 120.77451 |
Chemical Identifiers
| CAS Number | 104599-70-4 |
|---|---|
| SMILES | CCN/C=C/C(=O)OCC |
Product Overview
Ethyl 3-(ethylamino)acrylate (CAS 104599-70-4), with molecular formula C7H13NO2 and molecular weight 143.09 g/mol. IUPAC: ethyl (E)-3-(ethylamino)prop-2-enoate.
Chemical Property Profile of Ethyl 3-(ethylamino)acrylate
Property Insights of Ethyl 3-(ethylamino)acrylate
The XLogP value of 0.6727 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-(ethylamino)acrylate. With a topological polar surface area (TPSA) of 38.33 Ų, Ethyl 3-(ethylamino)acrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-(ethylamino)acrylate has 1 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 Ethyl 3-(ethylamino)acrylate?
The CAS number of Ethyl 3-(ethylamino)acrylate is 104599-70-4.
What is the molecular formula of Ethyl 3-(ethylamino)acrylate?
The molecular formula of Ethyl 3-(ethylamino)acrylate is C7H13NO2.
What is the molecular weight of Ethyl 3-(ethylamino)acrylate?
The molecular weight of Ethyl 3-(ethylamino)acrylate is 143.09 g/mol.
Where can I buy Ethyl 3-(ethylamino)acrylate?
You can request a quote for Ethyl 3-(ethylamino)acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(ethylamino)acrylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(ethylamino)acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.