TL;DR: 4,4-Dimethyl-2-nonyl-2-imidazoline-1-ethanol (CAS 74038-81-6) is a chemical compound with molecular formula C16H32N2O and molecular weight 268.25146 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(5,5-dimethyl-2-nonyl-4H-imidazol-3-yl)ethanol
Also Known As: 4,4-Dimethyl-2-nonyl-2-imidazoline-1-ethanol, 2-IMIDAZOLINE-1-ETHANOL, 4,4-DIMETHYL-2-NONYL-, 1H-Imidazole-1-ethanol, 4,5-dihydro-4,4-dimethyl-2-nonyl-, 2-(5,5-dimethyl-2-nonyl-4H-imidazol-3-yl)ethanol, 2-Imidazoline-1-ethanol,4-dimethyl-2-nonyl-
| Molecular Formula | C16H32N2O |
| Molecular Weight | 268.25146 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 35.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 268.25146 Da |
| Heavy Atoms | 19 |
| Complexity | 274.0 |
| SMILES | CCCCCCCCCC1=NC(CN1CCO)(C)C |
| InChIKey | LBXCABUUPOKOJP-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that 4,4-Dimethyl-2-nonyl-2-imidazoline-1-ethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.8 Ų, 4,4-Dimethyl-2-nonyl-2-imidazoline-1-ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4-Dimethyl-2-nonyl-2-imidazoline-1-ethanol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4,4-Dimethyl-2-nonyl-2-imidazoline-1-ethanol is 74038-81-6.
The molecular formula of 4,4-Dimethyl-2-nonyl-2-imidazoline-1-ethanol is C16H32N2O.
The molecular weight of 4,4-Dimethyl-2-nonyl-2-imidazoline-1-ethanol is 268.25146 g/mol.
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