Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3)
TL;DR: Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3) (CAS 89979-33-9) is a chemical compound with molecular formula C6H12K3NO9S3 and molecular weight 454.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tripotassium;1-[bis(1-sulfonatoethyl)amino]ethanesulfonate
Also Known As: Ethanesulfonic acid, 1,1',1''-nitrilotris-, tripotassium salt, Potassium 1,1',1''-nitrilotriethanesulfonate, Tripotassium 1,1',1''-nitrilotris(ethanesulphonate), Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3), 1,1',1''-Nitrilotri(ethanesulfonic acid potassium) salt
| Molecular Formula | C6H12K3NO9S3 |
|---|---|
| Molecular Weight | 454.86 g/mol |
| LogP | -11.026 |
| Topological Polar Surface Area | 200.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 454.85855 |
| Heavy Atoms | 22 |
| Complexity | 472.0 |
Chemical Identifiers
| CAS Number | 89979-33-9 |
|---|---|
| SMILES | CC(N(C(C)S(=O)(=O)[O-])C(C)S(=O)(=O)[O-])S(=O)(=O)[O-].[K+].[K+].[K+] |
| InChIKey | WLIOXCBCKHVPLL-UHFFFAOYSA-K |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3) (CAS 89979-33-9), with molecular formula C6H12K3NO9S3 and molecular weight 454.86 g/mol. IUPAC: tripotassium;1-[bis(1-sulfonatoethyl)amino]ethanesulfonate.
Chemical Property Profile of Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3)
Property Insights of Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3)
The XLogP value of -11.026 indicates that Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 200.0 Ų indicates high polarity, suggesting Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3) has 0 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 Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3)?
The CAS number of Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3) is 89979-33-9.
What is the molecular formula of Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3)?
The molecular formula of Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3) is C6H12K3NO9S3.
What is the molecular weight of Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3)?
The molecular weight of Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3) is 454.86 g/mol.
Where can I buy Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3)?
You can request a quote for Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3)?
Yes, KEHONG BIO provides custom synthesis services for Ethanesulfonic acid, 1,1',1''-nitrilotris-, potassium salt (1:3) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.