Methyl 2-(furan-2-yl)-2-oxoacetate
TL;DR: Methyl 2-(furan-2-yl)-2-oxoacetate (CAS 33245-13-5) is a chemical compound with molecular formula C7H6O4 and molecular weight 154.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(furan-2-yl)-2-oxoacetate
Also Known As: methyl 2-(furan-2-yl)-2-oxoacetate, methyl 2-furyl(oxo)acetate, Methyl alpha-oxofuran-2-acetate, Methyl, A-oxofuran-2-acetate
| Molecular Formula | C7H6O4 |
|---|---|
| Molecular Weight | 154.03 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 56.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 154.02661 |
| Heavy Atoms | 11 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 33245-13-5 |
|---|---|
| SMILES | COC(=O)C(=O)C1=CC=CO1 |
| InChIKey | ZHRNRBLRLWDFDH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 2-(furan-2-yl)-2-oxoacetate (CAS 33245-13-5), with molecular formula C7H6O4 and molecular weight 154.03 g/mol. IUPAC: methyl 2-(furan-2-yl)-2-oxoacetate.
Chemical Property Profile of Methyl 2-(furan-2-yl)-2-oxoacetate
Property Insights of Methyl 2-(furan-2-yl)-2-oxoacetate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(furan-2-yl)-2-oxoacetate. With a topological polar surface area (TPSA) of 56.5 Ų, Methyl 2-(furan-2-yl)-2-oxoacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-(furan-2-yl)-2-oxoacetate 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 Methyl 2-(furan-2-yl)-2-oxoacetate?
The CAS number of Methyl 2-(furan-2-yl)-2-oxoacetate is 33245-13-5.
What is the molecular formula of Methyl 2-(furan-2-yl)-2-oxoacetate?
The molecular formula of Methyl 2-(furan-2-yl)-2-oxoacetate is C7H6O4.
What is the molecular weight of Methyl 2-(furan-2-yl)-2-oxoacetate?
The molecular weight of Methyl 2-(furan-2-yl)-2-oxoacetate is 154.03 g/mol.
Where can I buy Methyl 2-(furan-2-yl)-2-oxoacetate?
You can request a quote for Methyl 2-(furan-2-yl)-2-oxoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(furan-2-yl)-2-oxoacetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(furan-2-yl)-2-oxoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.