Triethyl ethane-1,1,2-tricarboxylate
TL;DR: Triethyl ethane-1,1,2-tricarboxylate (CAS 7459-46-3) is a chemical compound with molecular formula C11H18O6 and molecular weight 246.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
triethyl ethane-1,1,2-tricarboxylate
Also Known As: Triethyl ethane-1,1,2-tricarboxylate, Triethyl 1,1,2-ethanetricarboxylate, 3-Iodomethyl-piperidine, Triethyl ethane tricarboxylate, 1,2-Tricarbethoxyethane
| Molecular Formula | C11H18O6 |
|---|---|
| Molecular Weight | 246.11 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 246.11034 |
| Heavy Atoms | 17 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 7459-46-3 |
|---|---|
| SMILES | CCOC(=O)CC(C(=O)OCC)C(=O)OCC |
| InChIKey | TVWZLLYAJDSSCJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Triethyl ethane-1,1,2-tricarboxylate (CAS 7459-46-3), with molecular formula C11H18O6 and molecular weight 246.11 g/mol. IUPAC: triethyl ethane-1,1,2-tricarboxylate.
Chemical Property Profile of Triethyl ethane-1,1,2-tricarboxylate
Property Insights of Triethyl ethane-1,1,2-tricarboxylate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Triethyl ethane-1,1,2-tricarboxylate. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Triethyl ethane-1,1,2-tricarboxylate. Following Lipinski's Rule of Five, Triethyl ethane-1,1,2-tricarboxylate has 0 hydrogen bond donor(s) and 6 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 Triethyl ethane-1,1,2-tricarboxylate?
The CAS number of Triethyl ethane-1,1,2-tricarboxylate is 7459-46-3.
What is the molecular formula of Triethyl ethane-1,1,2-tricarboxylate?
The molecular formula of Triethyl ethane-1,1,2-tricarboxylate is C11H18O6.
What is the molecular weight of Triethyl ethane-1,1,2-tricarboxylate?
The molecular weight of Triethyl ethane-1,1,2-tricarboxylate is 246.11 g/mol.
Where can I buy Triethyl ethane-1,1,2-tricarboxylate?
You can request a quote for Triethyl ethane-1,1,2-tricarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triethyl ethane-1,1,2-tricarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Triethyl ethane-1,1,2-tricarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.