TL;DR: 5-Chloro-2-phenyl-pentan-2-OL (CAS 126405-06-9) is a chemical compound with molecular formula C11H15ClO and molecular weight 198.08115 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-chloro-2-phenylpentan-2-ol
Also Known As: 5-chloro-2-phenylpentan-2-ol, NCIOpen2_001605, 2-Phenyl-5-chloro-2-pentanol, 5-CHLORO-2-PHENYL-PENTAN-2-OL, J3.548.384E
| Molecular Formula | C11H15ClO |
| Molecular Weight | 198.08115 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 198.08115 Da |
| Heavy Atoms | 13 |
| Complexity | 143.0 |
| SMILES | CC(CCCCl)(C1=CC=CC=C1)O |
| InChIKey | SXPWSYFGPRVEQY-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-2-phenyl-pentan-2-OL. With a topological polar surface area (TPSA) of 20.2 Ų, 5-Chloro-2-phenyl-pentan-2-OL exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-2-phenyl-pentan-2-OL has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-Chloro-2-phenyl-pentan-2-OL is 126405-06-9.
The molecular formula of 5-Chloro-2-phenyl-pentan-2-OL is C11H15ClO.
The molecular weight of 5-Chloro-2-phenyl-pentan-2-OL is 198.08115 g/mol.
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