Ethyl 3-(4-ethoxyphenyl)prop-2-enoate
TL;DR: Ethyl 3-(4-ethoxyphenyl)prop-2-enoate (CAS 1504-69-4) is a chemical compound with molecular formula C13H16O3 and molecular weight 220.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(4-ethoxyphenyl)prop-2-enoate
Also Known As: Ethyl p-ethoxycinnamate, Ethyl trans-4-ethoxycinnamate, ethyl 3-(4-ethoxyphenyl)prop-2-enoate, Ethyl (E)-3-(4-ethoxyphenyl)acrylate, Ethyl 3-(4-ethoxyphenyl)-2-propenoate
| Molecular Formula | C13H16O3 |
|---|---|
| Molecular Weight | 220.11 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 220.10994 |
| Heavy Atoms | 16 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 1504-69-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C=CC(=O)OCC |
| InChIKey | XFRWZVXVZIQXFI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 3-(4-ethoxyphenyl)prop-2-enoate (CAS 1504-69-4), with molecular formula C13H16O3 and molecular weight 220.11 g/mol. IUPAC: ethyl 3-(4-ethoxyphenyl)prop-2-enoate.
Chemical Property Profile of Ethyl 3-(4-ethoxyphenyl)prop-2-enoate
Property Insights of Ethyl 3-(4-ethoxyphenyl)prop-2-enoate
The XLogP value of 3.3 indicates that Ethyl 3-(4-ethoxyphenyl)prop-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Ethyl 3-(4-ethoxyphenyl)prop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-(4-ethoxyphenyl)prop-2-enoate 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 Ethyl 3-(4-ethoxyphenyl)prop-2-enoate?
The CAS number of Ethyl 3-(4-ethoxyphenyl)prop-2-enoate is 1504-69-4.
What is the molecular formula of Ethyl 3-(4-ethoxyphenyl)prop-2-enoate?
The molecular formula of Ethyl 3-(4-ethoxyphenyl)prop-2-enoate is C13H16O3.
What is the molecular weight of Ethyl 3-(4-ethoxyphenyl)prop-2-enoate?
The molecular weight of Ethyl 3-(4-ethoxyphenyl)prop-2-enoate is 220.11 g/mol.
Where can I buy Ethyl 3-(4-ethoxyphenyl)prop-2-enoate?
You can request a quote for Ethyl 3-(4-ethoxyphenyl)prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(4-ethoxyphenyl)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(4-ethoxyphenyl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.