Ammonium, hexamethylenebis(trimethyl-, dibenzoate
TL;DR: Ammonium, hexamethylenebis(trimethyl-, dibenzoate (CAS 103350-60-3) is a chemical compound with molecular formula C26H40N2O4 and molecular weight 444.2988 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trimethyl-[6-(trimethylazaniumyl)hexyl]azanium dibenzoate
Also Known As: Hexamethylenebis(trimethylammonium benzoate), AMMONIUM, HEXAMETHYLENEBIS(TRIMETHYL-, DIBENZOATE, trimethyl-(6-trimethylammoniohexyl)azanium dibenzoate, n,n,n,n',n',n'-hexamethylhexane-1,6-diaminium dibenzoate, trimethyl-[6-(trimethylazaniumyl)hexyl]azanium dibenzoate
Technical Specifications
| Molecular Formula | C26H40N2O4 |
| Molecular Weight | 444.2988 g/mol |
| XLogP | 2.06 |
| Topological Polar Surface Area (TPSA) | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 444.2988 Da |
| Heavy Atoms | 32 |
| Complexity | 219.0 |
| SMILES | C[N+](C)(C)CCCCCC[N+](C)(C)C.C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-] |
| InChIKey | PQFBXTALPNNDKO-UHFFFAOYSA-L |
Chemical Property Profile of Ammonium, hexamethylenebis(trimethyl-, dibenzoate
Property Insights of Ammonium, hexamethylenebis(trimethyl-, dibenzoate
The XLogP value of 2.06 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, hexamethylenebis(trimethyl-, dibenzoate. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Ammonium, hexamethylenebis(trimethyl-, dibenzoate. Following Lipinski's Rule of Five, Ammonium, hexamethylenebis(trimethyl-, dibenzoate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ammonium, hexamethylenebis(trimethyl-, dibenzoate?
The CAS number of Ammonium, hexamethylenebis(trimethyl-, dibenzoate is 103350-60-3.
What is the molecular formula of Ammonium, hexamethylenebis(trimethyl-, dibenzoate?
The molecular formula of Ammonium, hexamethylenebis(trimethyl-, dibenzoate is C26H40N2O4.
What is the molecular weight of Ammonium, hexamethylenebis(trimethyl-, dibenzoate?
The molecular weight of Ammonium, hexamethylenebis(trimethyl-, dibenzoate is 444.2988 g/mol.
Where can I buy Ammonium, hexamethylenebis(trimethyl-, dibenzoate?
You can request a quote for Ammonium, hexamethylenebis(trimethyl-, dibenzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ammonium, hexamethylenebis(trimethyl-, dibenzoate?
Yes, CoreyChem provides custom synthesis services for Ammonium, hexamethylenebis(trimethyl-, dibenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.