TL;DR: alpha-((2-(Dimethylamino)ethoxy)methyl)-4-fluorobenzenemethanol hydrochloride (CAS 131961-44-9) is a chemical compound with molecular formula C12H19ClFNO2 and molecular weight 263.10883 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(dimethylamino)ethoxy]-1-(4-fluorophenyl)ethanol;hydrochloride
Also Known As: alpha-((2-(Dimethylamino)ethoxy)methyl)-4-fluorobenzenemethanol hydrochloride, alpha-((2- -4-fluorobenzenemethanolhydrochloride, Benzenemethanol, alpha-((2-(dimethylamino)ethoxy)methyl)-4-fluoro-, hydrochloride, 2-[2-(dimethylamino)ethoxy]-1-(4-fluorophenyl)ethanol,hydroc, 2-(2-Dimethylaminoethoxy)-1-(4-Fluorophenyl)Ethanol Hydrochloride
| Molecular Formula | C12H19ClFNO2 |
| Molecular Weight | 263.10883 g/mol |
| XLogP | 1.8591 |
| Topological Polar Surface Area (TPSA) | 32.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 263.10883 Da |
| Heavy Atoms | 17 |
| Complexity | 182.0 |
| SMILES | CN(C)CCOCC(C1=CC=C(C=C1)F)O.Cl |
| InChIKey | QHQOZKFRPWATJD-UHFFFAOYSA-N |
The XLogP value of 1.8591 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-((2-(Dimethylamino)ethoxy)methyl)-4-fluorobenzenemethanol hydrochloride. With a topological polar surface area (TPSA) of 32.7 Ų, alpha-((2-(Dimethylamino)ethoxy)methyl)-4-fluorobenzenemethanol hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-((2-(Dimethylamino)ethoxy)methyl)-4-fluorobenzenemethanol hydrochloride has 2 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 alpha-((2-(Dimethylamino)ethoxy)methyl)-4-fluorobenzenemethanol hydrochloride is 131961-44-9.
The molecular formula of alpha-((2-(Dimethylamino)ethoxy)methyl)-4-fluorobenzenemethanol hydrochloride is C12H19ClFNO2.
The molecular weight of alpha-((2-(Dimethylamino)ethoxy)methyl)-4-fluorobenzenemethanol hydrochloride is 263.10883 g/mol.
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