TL;DR: Ammonium, N-butyl-N-ethyl-N,N',N',N'-tetramethyl-N,N'-oxydiethylenedi-, diiodide (CAS 64048-21-1) is a chemical compound with molecular formula C14H34I2N2O and molecular weight 500.07605 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
butyl-ethyl-methyl-[2-[2-(trimethylazaniumyl)ethoxy]ethyl]azanium diiodide
Also Known As: AS-13,671, AMMONIUM, N-BUTYL-N-ETHYL-N,N',N',N'-TETRAMETHYL-N,N'-OXYDIETHYLENEDI-, DIIODIDE, butyl-ethyl-methyl-[2-[2-(trimethylazaniumyl)ethoxy]ethyl]azanium diiodide, 1-Butanaminium, N-ethyl-N-methyl-N-[2-[2-(trimethylammonio)ethoxy]ethyl]-, diiodide, N-Ethyl-N-methyl-N-{2-[2-(trimethylazaniumyl)ethoxy]ethyl}butan-1-aminium diiodide
| Molecular Formula | C14H34I2N2O |
| Molecular Weight | 500.07605 g/mol |
| XLogP | -4.02 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 500.07605 Da |
| Heavy Atoms | 19 |
| Complexity | 189.0 |
| SMILES | CCCC[N+](C)(CC)CCOCC[N+](C)(C)C.[I-].[I-] |
| InChIKey | LCDSUTOOQPRVAF-UHFFFAOYSA-L |
The XLogP value of -4.02 indicates that Ammonium, N-butyl-N-ethyl-N,N',N',N'-tetramethyl-N,N'-oxydiethylenedi-, diiodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 9.2 Ų, Ammonium, N-butyl-N-ethyl-N,N',N',N'-tetramethyl-N,N'-oxydiethylenedi-, diiodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, N-butyl-N-ethyl-N,N',N',N'-tetramethyl-N,N'-oxydiethylenedi-, diiodide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Ammonium, N-butyl-N-ethyl-N,N',N',N'-tetramethyl-N,N'-oxydiethylenedi-, diiodide is 64048-21-1.
The molecular formula of Ammonium, N-butyl-N-ethyl-N,N',N',N'-tetramethyl-N,N'-oxydiethylenedi-, diiodide is C14H34I2N2O.
The molecular weight of Ammonium, N-butyl-N-ethyl-N,N',N',N'-tetramethyl-N,N'-oxydiethylenedi-, diiodide is 500.07605 g/mol.
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