Ethyl alpha-oxofuran-2-acetate
TL;DR: Ethyl alpha-oxofuran-2-acetate (CAS 1639-37-8) is a chemical compound with molecular formula C8H8O4 and molecular weight 168.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(furan-2-yl)-2-oxoacetate
Also Known As: Ethyl alpha-oxofuran-2-acetate, ethyl 2-(furan-2-yl)-2-oxoacetate, Ethyl furan-2-glyoxylate, Ethyl 2-furanglyoxylate, starbld0038540
| Molecular Formula | C8H8O4 |
|---|---|
| Molecular Weight | 168.04 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 56.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.04225 |
| Heavy Atoms | 12 |
| Complexity | 187.0 |
Chemical Identifiers
| CAS Number | 1639-37-8 |
|---|---|
| SMILES | CCOC(=O)C(=O)C1=CC=CO1 |
| InChIKey | GZEXNXJQYUBHHP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl alpha-oxofuran-2-acetate (CAS 1639-37-8), with molecular formula C8H8O4 and molecular weight 168.04 g/mol. IUPAC: ethyl 2-(furan-2-yl)-2-oxoacetate.
Chemical Property Profile of Ethyl alpha-oxofuran-2-acetate
Property Insights of Ethyl alpha-oxofuran-2-acetate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl alpha-oxofuran-2-acetate. With a topological polar surface area (TPSA) of 56.5 Ų, Ethyl alpha-oxofuran-2-acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl alpha-oxofuran-2-acetate 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 Ethyl alpha-oxofuran-2-acetate?
The CAS number of Ethyl alpha-oxofuran-2-acetate is 1639-37-8.
What is the molecular formula of Ethyl alpha-oxofuran-2-acetate?
The molecular formula of Ethyl alpha-oxofuran-2-acetate is C8H8O4.
What is the molecular weight of Ethyl alpha-oxofuran-2-acetate?
The molecular weight of Ethyl alpha-oxofuran-2-acetate is 168.04 g/mol.
Where can I buy Ethyl alpha-oxofuran-2-acetate?
You can request a quote for Ethyl alpha-oxofuran-2-acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl alpha-oxofuran-2-acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl alpha-oxofuran-2-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.