3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate
TL;DR: 3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate (CAS 65422-98-2) is a chemical compound with molecular formula C8H10N2O5 and molecular weight 214.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 1,2,5-oxadiazole-3,4-dicarboxylate
Also Known As: diethyl 1,2,5-oxadiazole-3,4-dicarboxylate, 3,4-diethyl 1,2,5-oxadiazole-3,4-dicarboxylate, ZERO/005367, diethyl furazan-3,4-dicarboxylate, furazan-3,4-dicarboxylic acid diethyl ester
| Molecular Formula | C8H10N2O5 |
|---|---|
| Molecular Weight | 214.06 g/mol |
| LogP | 0.423 |
| Topological Polar Surface Area | 91.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 214.05898 |
| Heavy Atoms | 15 |
| Complexity | 327.16895 |
Chemical Identifiers
| CAS Number | 65422-98-2 |
|---|---|
| SMILES | CCOC(=O)C1=NON=C1C(=O)OCC |
Product Overview
3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate (CAS 65422-98-2), with molecular formula C8H10N2O5 and molecular weight 214.06 g/mol. IUPAC: diethyl 1,2,5-oxadiazole-3,4-dicarboxylate.
Chemical Property Profile of 3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate
Property Insights of 3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate
The XLogP value of 0.423 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate. The TPSA of 91.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate. Following Lipinski's Rule of Five, 3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate has 0 hydrogen bond donor(s) and 7 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 3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate?
The CAS number of 3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate is 65422-98-2.
What is the molecular formula of 3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate?
The molecular formula of 3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate is C8H10N2O5.
What is the molecular weight of 3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate?
The molecular weight of 3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate is 214.06 g/mol.
Where can I buy 3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate?
You can request a quote for 3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Diethyl 1,2,5-oxadiazole-3,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.