Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate)
TL;DR: Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate) (CAS 72796-88-4) is a chemical compound with molecular formula C43H57N2O6S+ and molecular weight 729.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[6-[4-[4-[6-[2-[diethyl(methyl)azaniumyl]ethoxy]-1-bicyclo[4.2.0]octa-2,4,7-trienyl]phenyl]phenyl]-1-bicyclo[4.2.0]octa-2,4,7-trienyl]oxy]ethyl-diethyl-methylazanium;methyl sulfate
Also Known As: Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate), Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, methyl sulfate (1:2), (2,2'-((1,1'-Biphenyl)-4,4'-diylbis(ethylenephenyleneoxy))diethyl)bis(diethylmethylammonium) dimethyl bis(sulphate), [2,2'-[[1,1'-biphenyl]-4,4'-diylbis(ethylenephenyleneoxy)]diethyl]bis[diethylmethylammonium] dimethyl bis(sulphate), 2-[[1-[4-[4-[6-[2-[diethyl(methyl)azaniumyl]ethoxy]-1-bicyclo[4.2.0]octa-2,4,7-trienyl]phenyl]phenyl]-6-bicyclo[4.2.0]octa-2,4,7-trienyl]oxy]ethyl-diethyl-methylazanium; methyl sulfate
| Molecular Formula | C43H57N2O6S+ |
|---|---|
| Molecular Weight | 729.39 g/mol |
| LogP | 6.7974 |
| Topological Polar Surface Area | 93.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 15 |
| Exact Mass | 729.39374 |
| Heavy Atoms | 52 |
| Complexity | 1230.0 |
Chemical Identifiers
| CAS Number | 72796-88-4 |
|---|---|
| SMILES | CC[N+](C)(CC)CCOC12C=CC=CC1(C=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)C56C=CC=CC5(C=C6)OCC[N+](C)(CC)CC.COS(=O)(=O)[O-] |
| InChIKey | KZUDMOOKIUOVCC-UHFFFAOYSA-M |
Product Overview
Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate) (CAS 72796-88-4), with molecular formula C43H57N2O6S+ and molecular weight 729.39 g/mol. IUPAC: 2-[[6-[4-[4-[6-[2-[diethyl(methyl)azaniumyl]ethoxy]-1-bicyclo[4.2.0]octa-2,4,7-trienyl]phenyl]phenyl]-1-bicyclo[4.2.0]octa-2,4,7-trienyl]oxy]ethyl-diethyl-methylazanium;methyl sulfate.
Chemical Property Profile of Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate)
Property Insights of Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate)
The XLogP value of 6.7974 indicates that Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate). Following Lipinski's Rule of Five, Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate) has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate)?
The CAS number of Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate) is 72796-88-4.
What is the molecular formula of Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate)?
The molecular formula of Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate) is C43H57N2O6S+.
What is the molecular weight of Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate)?
The molecular weight of Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate) is 729.39 g/mol.
Where can I buy Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate)?
You can request a quote for Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate)?
Yes, KEHONG BIO provides custom synthesis services for Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.