TL;DR: 9,10-Dihydro-benzo(f)quinoline-9,10-diol, trans- (CAS 103667-12-5) is a chemical compound with molecular formula C13H11NO2 and molecular weight 213.07898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(9S,10S)-9,10-dihydrobenzo[f]quinoline-9,10-diol
Also Known As: Benzo(f)quinoline-9,10-dihydrodiol, 9,10-Dihydro-benzo(f)quinoline-9,10-diol, trans-, 9,10-Dihydrobenzo(f)quinoline-9,10-diol trans-, Benzo(f)quinoline-9,10-diol, 9,10-dihydro-, trans-, 9,10-Dihydrobenzo[f]quinoline-9,10-diol
| Molecular Formula | C13H11NO2 |
| Molecular Weight | 213.07898 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 53.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 213.07898 Da |
| Heavy Atoms | 16 |
| Complexity | 292.0 |
| SMILES | C1=CC2=C(C=CC3=C2[C@@H]([C@H](C=C3)O)O)N=C1 |
| InChIKey | NCMNKLTXFXNWHC-WCQYABFASA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9,10-Dihydro-benzo(f)quinoline-9,10-diol, trans-. With a topological polar surface area (TPSA) of 53.4 Ų, 9,10-Dihydro-benzo(f)quinoline-9,10-diol, trans- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9,10-Dihydro-benzo(f)quinoline-9,10-diol, trans- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 9,10-Dihydro-benzo(f)quinoline-9,10-diol, trans- is 103667-12-5.
The molecular formula of 9,10-Dihydro-benzo(f)quinoline-9,10-diol, trans- is C13H11NO2.
The molecular weight of 9,10-Dihydro-benzo(f)quinoline-9,10-diol, trans- is 213.07898 g/mol.
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