TL;DR: 5-Bromoquinolin-6-ol (CAS 115581-09-4) is a chemical compound with molecular formula C9H6BrNO and molecular weight 222.96329 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-bromoquinolin-6-ol
Also Known As: 5-bromoquinolin-6-ol, 5-Bromo-6-quinolinol, 6-Quinolinol, 5-bromo-, 5-Bromo-6-hydroxyquinoline, 5-Bromo-quinolin-6-ol
| Molecular Formula | C9H6BrNO |
| Molecular Weight | 222.96329 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 33.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 222.96329 Da |
| Heavy Atoms | 12 |
| Complexity | 165.0 |
| SMILES | C1=CC2=C(C=CC(=C2Br)O)N=C1 |
| InChIKey | HQEFDTSINGDBKQ-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromoquinolin-6-ol. With a topological polar surface area (TPSA) of 33.1 Ų, 5-Bromoquinolin-6-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromoquinolin-6-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 5-Bromoquinolin-6-ol is 115581-09-4.
The molecular formula of 5-Bromoquinolin-6-ol is C9H6BrNO.
The molecular weight of 5-Bromoquinolin-6-ol is 222.96329 g/mol.
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