Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate)
TL;DR: Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate) (CAS 103052-17-1) is a chemical compound with molecular formula C26H38N4O8 and molecular weight 534.269 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(4-nitrobenzoate);trimethyl-[6-(trimethylazaniumyl)hexyl]azanium
Also Known As: Hexamethylenebis(trimethylammonium p-nitrobenzoate), AMMONIUM, HEXAMETHYLENEBIS(TRIMETHYL-, BIS(p-NITROBENZOATE), 4-nitrobenzoate; trimethyl-[6-(trimethylazaniumyl)hexyl]azanium, 4-Nitrobenzoate; 4-nitrobenzoate;trimethyl-[6-(trimethylazaniumyl)hexyl]azanium, n,n,n,n',n',n'-hexamethylhexane-1,6-diaminium bis(4-nitrobenzoate)
Technical Specifications
| Molecular Formula | C26H38N4O8 |
| Molecular Weight | 534.269 g/mol |
| XLogP | 1.88 |
| Topological Polar Surface Area (TPSA) | 172.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 534.269 Da |
| Heavy Atoms | 38 |
| Complexity | 306.0 |
| SMILES | C[N+](C)(C)CCCCCC[N+](C)(C)C.C1=CC(=CC=C1C(=O)[O-])[N+](=O)[O-].C1=CC(=CC=C1C(=O)[O-])[N+](=O)[O-] |
| InChIKey | ABFPILRCTJLYDT-UHFFFAOYSA-L |
Chemical Property Profile of Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate)
Property Insights of Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate)
The XLogP value of 1.88 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate). The TPSA of 172.0 Ų indicates high polarity, suggesting Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate) has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate)?
The CAS number of Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate) is 103052-17-1.
What is the molecular formula of Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate)?
The molecular formula of Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate) is C26H38N4O8.
What is the molecular weight of Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate)?
The molecular weight of Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate) is 534.269 g/mol.
Where can I buy Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate)?
You can request a quote for Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate)?
Yes, CoreyChem provides custom synthesis services for Ammonium, hexamethylenebis(trimethyl-, bis(p-nitrobenzoate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.