N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate)
TL;DR: N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate) (CAS 68052-49-3) is a chemical compound with molecular formula C30H68N2O8S2 and molecular weight 648.44 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dibutyl-[6-[dibutyl(ethyl)azaniumyl]hexyl]-ethylazanium;ethyl sulfate
Also Known As: Tetrabutyldiethylhexamethylenediammonium ethylsulfate, 1,6-Hexanediaminium, N,N,N',N'-tetrabutyl-N,N'-diethyl-, bis(ethyl sulfate), N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate), S,S'-Diethyl N,N'-hexane-1,6-diylbis(dibutylethylammonium) disulphate, 1,6-Hexanediaminium, N1,N1,N6,N6-tetrabutyl-N1,N6-diethyl-, ethyl sulfate (1:2)
| Molecular Formula | C30H68N2O8S2 |
|---|---|
| Molecular Weight | 648.44 g/mol |
| LogP | 6.39 |
| Topological Polar Surface Area | 150.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 23 |
| Exact Mass | 648.4417 |
| Heavy Atoms | 42 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 68052-49-3 |
|---|---|
| SMILES | CCCC[N+](CC)(CCCC)CCCCCC[N+](CC)(CCCC)CCCC.CCOS(=O)(=O)[O-].CCOS(=O)(=O)[O-] |
| InChIKey | VYSDRTJTSAAZPP-UHFFFAOYSA-L |
Product Overview
N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate) (CAS 68052-49-3), with molecular formula C30H68N2O8S2 and molecular weight 648.44 g/mol. IUPAC: dibutyl-[6-[dibutyl(ethyl)azaniumyl]hexyl]-ethylazanium;ethyl sulfate.
Chemical Property Profile of N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate)
Property Insights of N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate)
The XLogP value of 6.39 indicates that N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 150.0 Ų indicates high polarity, suggesting N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate) has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate)?
The CAS number of N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate) is 68052-49-3.
What is the molecular formula of N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate)?
The molecular formula of N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate) is C30H68N2O8S2.
What is the molecular weight of N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate)?
The molecular weight of N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate) is 648.44 g/mol.
Where can I buy N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate)?
You can request a quote for N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate)?
Yes, KEHONG BIO provides custom synthesis services for N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium bis(ethyl sulfate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.