Ethyl 2-(benzofuran-3-yl)acetate
TL;DR: Ethyl 2-(benzofuran-3-yl)acetate (CAS 82156-58-9) is a chemical compound with molecular formula C12H12O3 and molecular weight 204.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(1-benzofuran-3-yl)acetate
Also Known As: ethyl 2-(benzofuran-3-yl)acetate, Ethyl 1-benzofuran-3-ylacetate, ethyl 2-(1-benzofuran-3-yl)acetate, Ethyl 2-(3-Benzofuranyl)acetate, Ethyl2-(benzofuran-3-yl)acetate
| Molecular Formula | C12H12O3 |
|---|---|
| Molecular Weight | 204.08 g/mol |
| LogP | 2.5384 |
| Topological Polar Surface Area | 39.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.07864 |
| Heavy Atoms | 15 |
| Complexity | 470.4269 |
Chemical Identifiers
| CAS Number | 82156-58-9 |
|---|---|
| SMILES | CCOC(=O)CC1=COC2=CC=CC=C21 |
Product Overview
Ethyl 2-(benzofuran-3-yl)acetate (CAS 82156-58-9), with molecular formula C12H12O3 and molecular weight 204.08 g/mol. IUPAC: ethyl 2-(1-benzofuran-3-yl)acetate.
Chemical Property Profile of Ethyl 2-(benzofuran-3-yl)acetate
Property Insights of Ethyl 2-(benzofuran-3-yl)acetate
The XLogP value of 2.5384 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(benzofuran-3-yl)acetate. With a topological polar surface area (TPSA) of 39.44 Ų, Ethyl 2-(benzofuran-3-yl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-(benzofuran-3-yl)acetate 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 2-(benzofuran-3-yl)acetate?
The CAS number of Ethyl 2-(benzofuran-3-yl)acetate is 82156-58-9.
What is the molecular formula of Ethyl 2-(benzofuran-3-yl)acetate?
The molecular formula of Ethyl 2-(benzofuran-3-yl)acetate is C12H12O3.
What is the molecular weight of Ethyl 2-(benzofuran-3-yl)acetate?
The molecular weight of Ethyl 2-(benzofuran-3-yl)acetate is 204.08 g/mol.
Where can I buy Ethyl 2-(benzofuran-3-yl)acetate?
You can request a quote for Ethyl 2-(benzofuran-3-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(benzofuran-3-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(benzofuran-3-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.