Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate
TL;DR: Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate (CAS 3002-18-4) is a chemical compound with molecular formula C12H21NO6 and molecular weight 275.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(2-acetyloxyethyl)amino]ethyl acetate
Also Known As: Triethanolamine triacetate, tris-(2-acetoxy-ethyl)-amine, 2,2',2''-Nitrilotrisethyl triacetate, nitrilotriethane-2,1-diyl triacetate, TEATA (Triethanolamine Triacetate)
| Molecular Formula | C12H21NO6 |
|---|---|
| Molecular Weight | 275.14 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 82.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 275.1369 |
| Heavy Atoms | 19 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 3002-18-4 |
|---|---|
| SMILES | CC(=O)OCCN(CCOC(=O)C)CCOC(=O)C |
| InChIKey | DJYQGDNOPVHONN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate (CAS 3002-18-4), with molecular formula C12H21NO6 and molecular weight 275.14 g/mol. IUPAC: 2-[bis(2-acetyloxyethyl)amino]ethyl acetate.
Chemical Property Profile of Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate
Property Insights of Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate
The XLogP value of -0.1 indicates that Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 82.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate. Following Lipinski's Rule of Five, Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate has 0 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 Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate?
The CAS number of Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate is 3002-18-4.
What is the molecular formula of Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate?
The molecular formula of Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate is C12H21NO6.
What is the molecular weight of Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate?
The molecular weight of Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate is 275.14 g/mol.
Where can I buy Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate?
You can request a quote for Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethanol, 2,2',2''-nitrilotris-, 1,1',1''-triacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.