Sodium caproamphoacetate
TL;DR: Sodium caproamphoacetate (CAS 14350-94-8) is a chemical compound with molecular formula C16H31N2NaO4 and molecular weight 338.21814 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
sodium;2-[1-(2-hydroxyethyl)-2-nonyl-4,5-dihydroimidazol-1-ium-1-yl]acetate;hydroxide
Also Known As: Sodium caproamphoacetate, Sodium 1-(carboxymethyl)-4,5-dihydro-1-(2-hydroxyethyl)-2-nonyl-1H-imidazolium hydroxide, 1H-Imidazolium, 1-(carboxymethyl)-4,5-dihydro-1-(2-hydroxyethyl)-2-nonyl-, hydroxide, monosodium salt, 4,5-Dihydro-2-nonyl-1H-imidazole-1-ethanol, carboxymethylated, sodium salt, 2-Imidazolinium, 1-(carboxymethyl)-1-(2-hydroxyethyl)-2-nonyl-, hydroxide, monosodium salt
Technical Specifications
| Molecular Formula | C16H31N2NaO4 |
| Molecular Weight | 338.21814 g/mol |
| XLogP | -2.07 |
| Topological Polar Surface Area (TPSA) | 73.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 338.21814 Da |
| Heavy Atoms | 23 |
| Complexity | 339.0 |
| SMILES | CCCCCCCCCC1=NCC[N+]1(CCO)CC(=O)[O-].[OH-].[Na+] |
| InChIKey | IQAXFTQMKLVRBK-UHFFFAOYSA-M |
Chemical Property Profile of Sodium caproamphoacetate
Property Insights of Sodium caproamphoacetate
The XLogP value of -2.07 indicates that Sodium caproamphoacetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 73.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Sodium caproamphoacetate. Following Lipinski's Rule of Five, Sodium caproamphoacetate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Sodium caproamphoacetate?
The CAS number of Sodium caproamphoacetate is 14350-94-8.
What is the molecular formula of Sodium caproamphoacetate?
The molecular formula of Sodium caproamphoacetate is C16H31N2NaO4.
What is the molecular weight of Sodium caproamphoacetate?
The molecular weight of Sodium caproamphoacetate is 338.21814 g/mol.
Where can I buy Sodium caproamphoacetate?
You can request a quote for Sodium caproamphoacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Sodium caproamphoacetate?
Yes, CoreyChem provides custom synthesis services for Sodium caproamphoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.