![3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester structure](/static/products/308/30853-80-6.png)
3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester
TL;DR: 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester (CAS 30853-80-6) is a chemical compound with molecular formula C16H18O4 and molecular weight 274.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[3-(3-ethoxy-3-oxoprop-1-enyl)phenyl]prop-2-enoate
Also Known As: 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester, ethyl 3-[3-(3-ethoxy-3-oxoprop-1-enyl)phenyl]prop-2-enoate, 2-Propenoic acid, 3,3'-(1,3-phenylene)bis-, diethyl ester (e
| Molecular Formula | C16H18O4 |
|---|---|
| Molecular Weight | 274.12 g/mol |
| LogP | 2.8392 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 274.1205 |
| Heavy Atoms | 20 |
| Complexity | 471.71307 |
Chemical Identifiers
| CAS Number | 30853-80-6 |
|---|---|
| SMILES | CCOC(=O)C=CC1=CC(=CC=C1)C=CC(=O)OCC |
Product Overview
3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester (CAS 30853-80-6), with molecular formula C16H18O4 and molecular weight 274.12 g/mol. IUPAC: ethyl 3-[3-(3-ethoxy-3-oxoprop-1-enyl)phenyl]prop-2-enoate.
Chemical Property Profile of 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester
Property Insights of 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester
The XLogP value of 2.8392 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester. With a topological polar surface area (TPSA) of 52.6 Ų, 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester has 0 hydrogen bond donor(s) and 4 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 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester?
The CAS number of 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester is 30853-80-6.
What is the molecular formula of 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester?
The molecular formula of 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester is C16H18O4.
What is the molecular weight of 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester?
The molecular weight of 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester is 274.12 g/mol.
Where can I buy 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester?
You can request a quote for 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester?
Yes, KEHONG BIO provides custom synthesis services for 3-[3-(2-Ethoxycarbonylvinyl)phenyl]-acrylic Acid Ethyl Ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.