TL;DR: (1S)-1-(4-bromophenyl)propan-1-ol (CAS 131320-21-3) is a chemical compound with molecular formula C9H11BrO and molecular weight 213.99933 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S)-1-(4-bromophenyl)propan-1-ol
Also Known As: (1S)-1-(4-bromophenyl)propan-1-ol, (S)-1-(4-Bromophenyl)-1-propanol, (S)-1-(p-Bromophenyl)-1-propanol, (S)-1-(4-bromophenyl)propan-1-ol, (1S)-1-(4-Bromophenyl)-1-propanol
| Molecular Formula | C9H11BrO |
| Molecular Weight | 213.99933 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 213.99933 Da |
| Heavy Atoms | 11 |
| Complexity | 108.0 |
| SMILES | CC[C@@H](C1=CC=C(C=C1)Br)O |
| InChIKey | QLMFTKHAIDWIDC-VIFPVBQESA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S)-1-(4-bromophenyl)propan-1-ol. With a topological polar surface area (TPSA) of 20.2 Ų, (1S)-1-(4-bromophenyl)propan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1S)-1-(4-bromophenyl)propan-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 (1S)-1-(4-bromophenyl)propan-1-ol is 131320-21-3.
The molecular formula of (1S)-1-(4-bromophenyl)propan-1-ol is C9H11BrO.
The molecular weight of (1S)-1-(4-bromophenyl)propan-1-ol is 213.99933 g/mol.
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