TL;DR: 1-(4-Chlorophenyl)-3-(dimethylamino)propan-1-ol (CAS 16254-21-0) is a chemical compound with molecular formula C11H16ClNO and molecular weight 213.09204 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-chlorophenyl)-3-(dimethylamino)propan-1-ol
Also Known As: 1-(4-chlorophenyl)-3-(dimethylamino)propan-1-ol, O-TOLYL-ACETYLCHLORIDE, FURO[2,3-B]PYRIDINE-2-METHANOL, Benzenemethanol, 4-chloro-alpha-[2-(dimethylamino)ethyl]-, 1-(4-Chlorophenyl)-3-dimethylamino-propan-1-ol
| Molecular Formula | C11H16ClNO |
| Molecular Weight | 213.09204 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 213.09204 Da |
| Heavy Atoms | 14 |
| Complexity | 155.0 |
| SMILES | CN(C)CCC(C1=CC=C(C=C1)Cl)O |
| InChIKey | GXYMVYGPHADUNW-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Chlorophenyl)-3-(dimethylamino)propan-1-ol. With a topological polar surface area (TPSA) of 23.5 Ų, 1-(4-Chlorophenyl)-3-(dimethylamino)propan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-3-(dimethylamino)propan-1-ol 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 1-(4-Chlorophenyl)-3-(dimethylamino)propan-1-ol is 16254-21-0.
The molecular formula of 1-(4-Chlorophenyl)-3-(dimethylamino)propan-1-ol is C11H16ClNO.
The molecular weight of 1-(4-Chlorophenyl)-3-(dimethylamino)propan-1-ol is 213.09204 g/mol.
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