EDTA-TRIETHYL ESTER
TL;DR: EDTA-TRIETHYL ESTER (CAS 90359-20-9) is a chemical compound with molecular formula C16H28N2O8 and molecular weight 376.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[bis(2-ethoxy-2-oxoethyl)amino]ethyl-(2-ethoxy-2-oxoethyl)amino]acetic acid
Also Known As: EDTA-TRIETHYL ESTER, J1.024.112J, N-(2-(Bis(2-ethoxy-2-oxoethyl)amino)ethyl)-N-(2-ethoxy-2-oxoethyl)glycine, N-[2-[Bis(ethoxycarbonylmethyl)amino]ethyl]-N-(ethoxycarbonylmethyl)glycine, [(2-[Bis(2-ethoxy-2-oxoethyl)amino]ethyl)(2-ethoxy-2-oxoethyl)amino]acetic acid
| Molecular Formula | C16H28N2O8 |
|---|---|
| Molecular Weight | 376.18 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 17 |
| Exact Mass | 376.18457 |
| Heavy Atoms | 26 |
| Complexity | 449.0 |
Chemical Identifiers
| CAS Number | 90359-20-9 |
|---|---|
| SMILES | CCOC(=O)CN(CCN(CC(=O)OCC)CC(=O)OCC)CC(=O)O |
| InChIKey | REINYWRAXSPVIS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
EDTA-TRIETHYL ESTER (CAS 90359-20-9), with molecular formula C16H28N2O8 and molecular weight 376.18 g/mol. IUPAC: 2-[2-[bis(2-ethoxy-2-oxoethyl)amino]ethyl-(2-ethoxy-2-oxoethyl)amino]acetic acid.
Chemical Property Profile of EDTA-TRIETHYL ESTER
Property Insights of EDTA-TRIETHYL ESTER
The XLogP value of -1.5 indicates that EDTA-TRIETHYL ESTER is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for EDTA-TRIETHYL ESTER. Following Lipinski's Rule of Five, EDTA-TRIETHYL ESTER has 1 hydrogen bond donor(s) and 10 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 EDTA-TRIETHYL ESTER?
The CAS number of EDTA-TRIETHYL ESTER is 90359-20-9.
What is the molecular formula of EDTA-TRIETHYL ESTER?
The molecular formula of EDTA-TRIETHYL ESTER is C16H28N2O8.
What is the molecular weight of EDTA-TRIETHYL ESTER?
The molecular weight of EDTA-TRIETHYL ESTER is 376.18 g/mol.
Where can I buy EDTA-TRIETHYL ESTER?
You can request a quote for EDTA-TRIETHYL ESTER directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EDTA-TRIETHYL ESTER?
Yes, KEHONG BIO provides custom synthesis services for EDTA-TRIETHYL ESTER and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.