Diethyl 2,5-furandicarboxylate
TL;DR: Diethyl 2,5-furandicarboxylate (CAS 53662-83-2) is a chemical compound with molecular formula C10H12O5 and molecular weight 212.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl furan-2,5-dicarboxylate
Also Known As: diethyl furan-2,5-dicarboxylate, 2,5-FURANDICARBOXYLIC ACID DIETHYL ESTER, FDCA-diethyl ester, Diethyl 2,5-furandicarboxylate, MANGANESETITANATE
| Molecular Formula | C10H12O5 |
|---|---|
| Molecular Weight | 212.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 65.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 212.06847 |
| Heavy Atoms | 15 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 53662-83-2 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(O1)C(=O)OCC |
| InChIKey | PHGMGTWRSNXLDV-UHFFFAOYSA-N |
Product Overview
Diethyl 2,5-furandicarboxylate (CAS 53662-83-2), with molecular formula C10H12O5 and molecular weight 212.07 g/mol. IUPAC: diethyl furan-2,5-dicarboxylate.
Chemical Property Profile of Diethyl 2,5-furandicarboxylate
Property Insights of Diethyl 2,5-furandicarboxylate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 2,5-furandicarboxylate. The TPSA of 65.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2,5-furandicarboxylate. Following Lipinski's Rule of Five, Diethyl 2,5-furandicarboxylate has 0 hydrogen bond donor(s) and 5 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 Diethyl 2,5-furandicarboxylate?
The CAS number of Diethyl 2,5-furandicarboxylate is 53662-83-2.
What is the molecular formula of Diethyl 2,5-furandicarboxylate?
The molecular formula of Diethyl 2,5-furandicarboxylate is C10H12O5.
What is the molecular weight of Diethyl 2,5-furandicarboxylate?
The molecular weight of Diethyl 2,5-furandicarboxylate is 212.07 g/mol.
Where can I buy Diethyl 2,5-furandicarboxylate?
You can request a quote for Diethyl 2,5-furandicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2,5-furandicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2,5-furandicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.