Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate
TL;DR: Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate (CAS 65277-54-5) is a chemical compound with molecular formula C24H41NNa2O9S and molecular weight 565.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;4-[2-(12-hydroxyoctadec-9-enoylamino)ethoxy]-4-oxo-3-sulfonatobutanoate
Also Known As: DISODIUM 4-[2-(12-HYDROXYOCTADEC-9-ENAMIDO)ETHOXY]-4-OXO-3-SULFONATOBUTANOATE, Butanedioic acid, sulfo-, 1-[2-[(12-hydroxy-1-oxo-9-octadecenyl)amino]ethyl] ester, disodium salt
| Molecular Formula | C24H41NNa2O9S |
|---|---|
| Molecular Weight | 565.23 g/mol |
| LogP | -4.28 |
| Topological Polar Surface Area | 181.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 21 |
| Exact Mass | 565.22974 |
| Heavy Atoms | 37 |
| Complexity | 713.0 |
Chemical Identifiers
| CAS Number | 65277-54-5 |
|---|---|
| SMILES | CCCCCCC(CC=CCCCCCCCC(=O)NCCOC(=O)C(CC(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+] |
| InChIKey | LRBYMRRGKYPBDR-UHFFFAOYSA-L |
Product Overview
Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate (CAS 65277-54-5), with molecular formula C24H41NNa2O9S and molecular weight 565.23 g/mol. IUPAC: disodium;4-[2-(12-hydroxyoctadec-9-enoylamino)ethoxy]-4-oxo-3-sulfonatobutanoate.
Chemical Property Profile of Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate
Property Insights of Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate
The XLogP value of -4.28 indicates that Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 181.0 Ų indicates high polarity, suggesting Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate?
The CAS number of Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate is 65277-54-5.
What is the molecular formula of Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate?
The molecular formula of Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate is C24H41NNa2O9S.
What is the molecular weight of Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate?
The molecular weight of Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate is 565.23 g/mol.
Where can I buy Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate?
You can request a quote for Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Disodium 4-[2-(12-hydroxyoctadec-9-enamido)ethoxy]-4-oxo-3-sulfonatobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.