TL;DR: Triethylene glycol hexyl ether (CAS 25961-89-1) is a chemical compound with molecular formula C12H26O4 and molecular weight 234.1831 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(2-hexoxyethoxy)ethoxy]ethanol
Also Known As: n-Hexyltrioxyethylene, Triethylene glycol monohexyl ether, Hexyltriglycol, Triethylene glycol hexyl ether, CHR 9
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H26O4 |
| Molecular Weight | 234.1831 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 47.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 234.1831 Da |
| Heavy Atoms | 16 |
| Complexity | 120.0 |
| SMILES | CCCCCCOCCOCCOCCO |
| InChIKey | RGICCULPCWNRAB-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Triethylene glycol hexyl ether. With a topological polar surface area (TPSA) of 47.9 Ų, Triethylene glycol hexyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Triethylene glycol hexyl ether has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Triethylene glycol hexyl ether is 25961-89-1.
The molecular formula of Triethylene glycol hexyl ether is C12H26O4.
The molecular weight of Triethylene glycol hexyl ether is 234.1831 g/mol.
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