TL;DR: 1-[4-(Propan-2-yl)phenyl]ethan-1-ol (CAS 105364-42-9) is a chemical compound with molecular formula C11H16O and molecular weight 164.12012 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-propan-2-ylphenyl)ethanol
Also Known As: 1-[4-(propan-2-yl)phenyl]ethan-1-ol, 1-(4-isopropylphenyl)ethan-1-ol, 1-(4-isopropylphenyl)ethanol, 1-(4-propan-2-ylphenyl)ethanol, 1-(4-iso-Propylphenyl)ethanol
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H16O |
| Molecular Weight | 164.12012 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 164.12012 Da |
| Heavy Atoms | 12 |
| Complexity | 123.0 |
| SMILES | CC(C)C1=CC=C(C=C1)C(C)O |
| InChIKey | LPWMXVJCBUKVQH-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4-(Propan-2-yl)phenyl]ethan-1-ol. With a topological polar surface area (TPSA) of 20.2 Ų, 1-[4-(Propan-2-yl)phenyl]ethan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-(Propan-2-yl)phenyl]ethan-1-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 1-[4-(Propan-2-yl)phenyl]ethan-1-ol is 105364-42-9.
The molecular formula of 1-[4-(Propan-2-yl)phenyl]ethan-1-ol is C11H16O.
The molecular weight of 1-[4-(Propan-2-yl)phenyl]ethan-1-ol is 164.12012 g/mol.
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