TL;DR: Ammonium, ((propylethylene)bis(p-phenyleneoxyethylene))bis(trimethyl-, diiodide (CAS 120526-90-1) is a chemical compound with molecular formula C27H44I2N2O2 and molecular weight 682.14923 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trimethyl-[2-[4-[1-[4-[2-(trimethylazaniumyl)ethoxy]phenyl]pentan-2-yl]phenoxy]ethyl]azanium diiodide
Also Known As: ((Propylethylene)bis(p-phenyleneoxyethylene))bis(trimethylammonium iodide), AMMONIUM, ((PROPYLETHYLENE)BIS(p-PHENYLENEOXYETHYLENE))BIS(TRIMETHYL-, DIIODIDE, 2,2'-[Pentane-1,2-diylbis(4,1-phenyleneoxy)]bis(N,N,N-trimethylethan-1-aminium) diiodide, 2,2'-[pentane-1,2-diylbis(benzene-4,1-diyloxy)]bis(n,n,n-trimethylethanaminium) diiodide, 2,2'-{Pentane-1,2-diylbis[(4,1-phenylene)oxy]}bis(N,N,N-trimethylethan-1-aminium) diiodide
| Molecular Formula | C27H44I2N2O2 |
| Molecular Weight | 682.14923 g/mol |
| XLogP | -1.01 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 682.14923 Da |
| Heavy Atoms | 33 |
| Complexity | 467.0 |
| SMILES | CCCC(CC1=CC=C(C=C1)OCC[N+](C)(C)C)C2=CC=C(C=C2)OCC[N+](C)(C)C.[I-].[I-] |
| InChIKey | GUFOYWWEQUKYHB-UHFFFAOYSA-L |
The XLogP value of -1.01 indicates that Ammonium, ((propylethylene)bis(p-phenyleneoxyethylene))bis(trimethyl-, diiodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 18.5 Ų, Ammonium, ((propylethylene)bis(p-phenyleneoxyethylene))bis(trimethyl-, diiodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, ((propylethylene)bis(p-phenyleneoxyethylene))bis(trimethyl-, diiodide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Ammonium, ((propylethylene)bis(p-phenyleneoxyethylene))bis(trimethyl-, diiodide is 120526-90-1.
The molecular formula of Ammonium, ((propylethylene)bis(p-phenyleneoxyethylene))bis(trimethyl-, diiodide is C27H44I2N2O2.
The molecular weight of Ammonium, ((propylethylene)bis(p-phenyleneoxyethylene))bis(trimethyl-, diiodide is 682.14923 g/mol.
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