Triethyl 1-hydroxyethane-1,1,2-tricarboxylate
TL;DR: Triethyl 1-hydroxyethane-1,1,2-tricarboxylate (CAS 100053-89-2) is a chemical compound with molecular formula C11H18O7 and molecular weight 262.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
triethyl 1-hydroxyethane-1,1,2-tricarboxylate
Also Known As: diethyl 2-ethyloxycarbonyl-2-hydroxysuccinate, 1,1,2-triethyl 1-hydroxyethane-1,1,2-tricarboxylate, 1-hydroxy-ethane-1,1,2-tricarboxylic acid triethyl ester
| Molecular Formula | C11H18O7 |
|---|---|
| Molecular Weight | 262.11 g/mol |
| LogP | -0.2031 |
| Topological Polar Surface Area | 99.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 262.10526 |
| Heavy Atoms | 18 |
| Complexity | 292.51358 |
Chemical Identifiers
| CAS Number | 100053-89-2 |
|---|---|
| SMILES | CCOC(=O)CC(C(=O)OCC)(C(=O)OCC)O |
Product Overview
Triethyl 1-hydroxyethane-1,1,2-tricarboxylate (CAS 100053-89-2), with molecular formula C11H18O7 and molecular weight 262.11 g/mol. IUPAC: triethyl 1-hydroxyethane-1,1,2-tricarboxylate.
Chemical Property Profile of Triethyl 1-hydroxyethane-1,1,2-tricarboxylate
Property Insights of Triethyl 1-hydroxyethane-1,1,2-tricarboxylate
The XLogP value of -0.2031 indicates that Triethyl 1-hydroxyethane-1,1,2-tricarboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Triethyl 1-hydroxyethane-1,1,2-tricarboxylate. Following Lipinski's Rule of Five, Triethyl 1-hydroxyethane-1,1,2-tricarboxylate has 1 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 Triethyl 1-hydroxyethane-1,1,2-tricarboxylate?
The CAS number of Triethyl 1-hydroxyethane-1,1,2-tricarboxylate is 100053-89-2.
What is the molecular formula of Triethyl 1-hydroxyethane-1,1,2-tricarboxylate?
The molecular formula of Triethyl 1-hydroxyethane-1,1,2-tricarboxylate is C11H18O7.
What is the molecular weight of Triethyl 1-hydroxyethane-1,1,2-tricarboxylate?
The molecular weight of Triethyl 1-hydroxyethane-1,1,2-tricarboxylate is 262.11 g/mol.
Where can I buy Triethyl 1-hydroxyethane-1,1,2-tricarboxylate?
You can request a quote for Triethyl 1-hydroxyethane-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 1-hydroxyethane-1,1,2-tricarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Triethyl 1-hydroxyethane-1,1,2-tricarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.