Ethyl 2-furoate
TL;DR: Ethyl 2-furoate (CAS 614-99-3) is a chemical compound with molecular formula C7H8O3 and molecular weight 140.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl furan-2-carboxylate
Also Known As: ETHYL 2-FUROATE, Ethyl furan-2-carboxylate, Ethyl furoate, Ethyl pyromucate, Ethyl-2-furoate
| Molecular Formula | C7H8O3 |
|---|---|
| Molecular Weight | 140.05 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 140.04735 |
| Heavy Atoms | 10 |
| Complexity | 122.0 |
| Melting Point | 34.5 °C |
| Boiling Point | 196.8 °C @760 [mm Hg] |
| Density | 1.1174 @ 21°C |
Chemical Identifiers
| CAS Number | 614-99-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC=CO1 |
| InChIKey | NHXSTXWKZVAVOQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 2-furoate (CAS 614-99-3), with molecular formula C7H8O3 and molecular weight 140.05 g/mol. IUPAC: ethyl furan-2-carboxylate.
Chemical Property Profile of Ethyl 2-furoate
Property Insights of Ethyl 2-furoate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-furoate. With a topological polar surface area (TPSA) of 39.4 Ų, Ethyl 2-furoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-furoate 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-furoate?
The CAS number of Ethyl 2-furoate is 614-99-3.
What is the molecular formula of Ethyl 2-furoate?
The molecular formula of Ethyl 2-furoate is C7H8O3.
What is the molecular weight of Ethyl 2-furoate?
The molecular weight of Ethyl 2-furoate is 140.05 g/mol.
Where can I buy Ethyl 2-furoate?
You can request a quote for Ethyl 2-furoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-furoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-furoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.