TL;DR: 5,5'-Oxybis(N,N,N-triethylpentan-1-aminium) diiodide (CAS 114302-98-6) is a chemical compound with molecular formula C22H50I2N2O and molecular weight 612.20123 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
triethyl-[5-[5-(triethylazaniumyl)pentoxy]pentyl]azanium diiodide
Also Known As: (Oxybis(pentamethylene))bis(triethylammonium iodide), 5,5'-oxybis(n,n,n-triethylpentan-1-aminium) diiodide, AMMONIUM, (OXYBIS(PENTAMETHYLENE))BIS(TRIETHYL-, DIIODIDE, triethyl-[5-[5-(triethylazaniumyl)pentoxy]pentyl]azanium diiodide
| Molecular Formula | C22H50I2N2O |
| Molecular Weight | 612.20123 g/mol |
| XLogP | -0.9 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 18 |
| Exact Mass | 612.20123 Da |
| Heavy Atoms | 27 |
| Complexity | 241.0 |
| SMILES | CC[N+](CC)(CC)CCCCCOCCCCC[N+](CC)(CC)CC.[I-].[I-] |
| InChIKey | IFARTRMGJXQQEK-UHFFFAOYSA-L |
The XLogP value of -0.9 indicates that 5,5'-Oxybis(N,N,N-triethylpentan-1-aminium) 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, 5,5'-Oxybis(N,N,N-triethylpentan-1-aminium) diiodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5'-Oxybis(N,N,N-triethylpentan-1-aminium) diiodide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 5,5'-Oxybis(N,N,N-triethylpentan-1-aminium) diiodide is 114302-98-6.
The molecular formula of 5,5'-Oxybis(N,N,N-triethylpentan-1-aminium) diiodide is C22H50I2N2O.
The molecular weight of 5,5'-Oxybis(N,N,N-triethylpentan-1-aminium) diiodide is 612.20123 g/mol.
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