TL;DR: 6,7-Difluoroquinolin-4-OL (CAS 1215770-40-3) is a chemical compound with molecular formula C9H5F2NO and molecular weight 181.03392 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6,7-difluoro-1H-quinolin-4-one
Also Known As: 6,7-DIFLUOROQUINOLIN-4-OL, 6,7-difluoroquinolin-4(1H)-one, 4(1H)-Quinolinone,6,7-difluoro-, 6,7-difluoro-1H-quinolin-4-one, 6,7-difluorohydroquinolin-4-one
| Molecular Formula | C9H5F2NO |
| Molecular Weight | 181.03392 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 181.03392 Da |
| Heavy Atoms | 13 |
| Complexity | 254.0 |
| SMILES | C1=CNC2=CC(=C(C=C2C1=O)F)F |
| InChIKey | XMNIOWFLDGXFJS-UHFFFAOYSA-N |
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-Difluoroquinolin-4-OL. With a topological polar surface area (TPSA) of 29.1 Ų, 6,7-Difluoroquinolin-4-OL exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-Difluoroquinolin-4-OL has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 6,7-Difluoroquinolin-4-OL is 1215770-40-3.
The molecular formula of 6,7-Difluoroquinolin-4-OL is C9H5F2NO.
The molecular weight of 6,7-Difluoroquinolin-4-OL is 181.03392 g/mol.
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