Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate
TL;DR: Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate (CAS 680215-57-0) is a chemical compound with molecular formula C19H26O8S and molecular weight 414.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetraethyl 2-thiophen-2-ylpropane-1,1,3,3-tetracarboxylate
Also Known As: tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate, tetraethyl 2-thiophen-2-ylpropane-1,1,3,3-tetracarboxylate, J2.508.093I, TETRAETHYL2- PROPANE-1,1,3,3-TETRACARBOXYLATE, 1,1,3,3-tetraethyl 2-(thiophen-2-yl)propane-1,1,3,3-tetracarboxylate
| Molecular Formula | C19H26O8S |
|---|---|
| Molecular Weight | 414.13 g/mol |
| LogP | 2.3165 |
| Topological Polar Surface Area | 105.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 414.13483 |
| Heavy Atoms | 28 |
| Complexity | 578.9007 |
Chemical Identifiers
| CAS Number | 680215-57-0 |
|---|---|
| SMILES | CCOC(=O)C(C(C1=CC=CS1)C(C(=O)OCC)C(=O)OCC)C(=O)OCC |
Product Overview
Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate (CAS 680215-57-0), with molecular formula C19H26O8S and molecular weight 414.13 g/mol. IUPAC: tetraethyl 2-thiophen-2-ylpropane-1,1,3,3-tetracarboxylate.
Chemical Property Profile of Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate
Property Insights of Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate
The XLogP value of 2.3165 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate. The TPSA of 105.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate. Following Lipinski's Rule of Five, Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate has 0 hydrogen bond donor(s) and 9 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 Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate?
The CAS number of Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate is 680215-57-0.
What is the molecular formula of Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate?
The molecular formula of Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate is C19H26O8S.
What is the molecular weight of Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate?
The molecular weight of Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate is 414.13 g/mol.
Where can I buy Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate?
You can request a quote for Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Tetraethyl 2-(2-thienyl)propane-1,1,3,3-tetracarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.