Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate
TL;DR: Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate (CAS 13896-31-6) is a chemical compound with molecular formula C18H28O8 and molecular weight 372.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetraethyl cyclohexane-1,1,4,4-tetracarboxylate
Also Known As: tetraethyl cyclohexane-1,1,4,4-tetracarboxylate
| Molecular Formula | C18H28O8 |
|---|---|
| Molecular Weight | 372.18 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 12 |
| Exact Mass | 372.1784 |
| Heavy Atoms | 26 |
| Complexity | 443.0 |
Chemical Identifiers
| CAS Number | 13896-31-6 |
|---|---|
| SMILES | CCOC(=O)C1(CCC(CC1)(C(=O)OCC)C(=O)OCC)C(=O)OCC |
| InChIKey | XRCRHLAYCMNZTJ-UHFFFAOYSA-N |
Product Overview
Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate (CAS 13896-31-6), with molecular formula C18H28O8 and molecular weight 372.18 g/mol. IUPAC: tetraethyl cyclohexane-1,1,4,4-tetracarboxylate.
Chemical Property Profile of Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate
Property Insights of Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate. Following Lipinski's Rule of Five, Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate has 0 hydrogen bond donor(s) and 8 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 cyclohexane-1,1,4,4-tetracarboxylate?
The CAS number of Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate is 13896-31-6.
What is the molecular formula of Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate?
The molecular formula of Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate is C18H28O8.
What is the molecular weight of Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate?
The molecular weight of Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate is 372.18 g/mol.
Where can I buy Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate?
You can request a quote for Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Tetraethyl cyclohexane-1,1,4,4-tetracarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.