Triethanolamine hexadecyl sulfate
TL;DR: Triethanolamine hexadecyl sulfate (CAS 4492-79-9) is a chemical compound with molecular formula C22H49NO7S and molecular weight 471.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(2-hydroxyethyl)amino]ethanol;hexadecyl hydrogen sulfate
Also Known As: Triethanolamine hexadecyl sulfate, Triethanolamine palmityl sulfate, Tris(2-hydroxyethyl)ammonium hexadecyl sulphate, 1-Hexadecanol, sulfate (1:1), triethanolamine salt (1:1), 2-[bis(2-hydroxyethyl)amino]ethanol,hexadecyl hydrogen sulfate
| Molecular Formula | C22H49NO7S |
|---|---|
| Molecular Weight | 471.32 g/mol |
| LogP | 3.55 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 22 |
| Exact Mass | 471.32297 |
| Heavy Atoms | 31 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 4492-79-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCOS(=O)(=O)O.C(CO)N(CCO)CCO |
| InChIKey | UUVOKWOMCSTLLR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Triethanolamine hexadecyl sulfate (CAS 4492-79-9), with molecular formula C22H49NO7S and molecular weight 471.32 g/mol. IUPAC: 2-[bis(2-hydroxyethyl)amino]ethanol;hexadecyl hydrogen sulfate.
Chemical Property Profile of Triethanolamine hexadecyl sulfate
Property Insights of Triethanolamine hexadecyl sulfate
The XLogP value of 3.55 indicates that Triethanolamine hexadecyl sulfate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Triethanolamine hexadecyl sulfate. Following Lipinski's Rule of Five, Triethanolamine hexadecyl sulfate has 4 hydrogen bond donor(s) and 8 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 Triethanolamine hexadecyl sulfate?
The CAS number of Triethanolamine hexadecyl sulfate is 4492-79-9.
What is the molecular formula of Triethanolamine hexadecyl sulfate?
The molecular formula of Triethanolamine hexadecyl sulfate is C22H49NO7S.
What is the molecular weight of Triethanolamine hexadecyl sulfate?
The molecular weight of Triethanolamine hexadecyl sulfate is 471.32 g/mol.
Where can I buy Triethanolamine hexadecyl sulfate?
You can request a quote for Triethanolamine hexadecyl sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triethanolamine hexadecyl sulfate?
Yes, KEHONG BIO provides custom synthesis services for Triethanolamine hexadecyl sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.