Ethyl 4-ethoxyphenylacetate
TL;DR: Ethyl 4-ethoxyphenylacetate (CAS 40784-88-1) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(4-ethoxyphenyl)acetate
Also Known As: ETHYL 4-ETHOXYPHENYLACETATE, ethyl 2-(4-ethoxyphenyl)acetate, ethyl p-ethoxyphenylacetate, ethyl-p-ethoxyphenylacetate, ethyl (4-ethoxyphenyl)acetate
| Molecular Formula | C12H16O3 |
|---|---|
| Molecular Weight | 208.11 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 208.10994 |
| Heavy Atoms | 15 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 40784-88-1 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)CC(=O)OCC |
| InChIKey | KZWVNVPYBUGYTA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 4-ethoxyphenylacetate (CAS 40784-88-1), with molecular formula C12H16O3 and molecular weight 208.11 g/mol. IUPAC: ethyl 2-(4-ethoxyphenyl)acetate.
Chemical Property Profile of Ethyl 4-ethoxyphenylacetate
Property Insights of Ethyl 4-ethoxyphenylacetate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-ethoxyphenylacetate. With a topological polar surface area (TPSA) of 35.5 Ų, Ethyl 4-ethoxyphenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-ethoxyphenylacetate 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 4-ethoxyphenylacetate?
The CAS number of Ethyl 4-ethoxyphenylacetate is 40784-88-1.
What is the molecular formula of Ethyl 4-ethoxyphenylacetate?
The molecular formula of Ethyl 4-ethoxyphenylacetate is C12H16O3.
What is the molecular weight of Ethyl 4-ethoxyphenylacetate?
The molecular weight of Ethyl 4-ethoxyphenylacetate is 208.11 g/mol.
Where can I buy Ethyl 4-ethoxyphenylacetate?
You can request a quote for Ethyl 4-ethoxyphenylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-ethoxyphenylacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-ethoxyphenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.