TL;DR: 2'-Fluoro-6'-methoxyacetophenone (CAS 120484-50-6) is a chemical compound with molecular formula C9H9FO2 and molecular weight 168.05865 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-fluoro-6-methoxyphenyl)ethanone
Also Known As: 1-(2-fluoro-6-methoxyphenyl)ethanone, 2'-Fluoro-6'-methoxyacetophenone, 2-FLUORO-6-METHOXYACETOPHENONE, 1-(2-Fluoro-6-methoxy-phenyl)ethanone, 1-(2-fluoro-6-methoxyphenyl)ethan-1-one
| Molecular Formula | C9H9FO2 |
| Molecular Weight | 168.05865 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 168.05865 Da |
| Heavy Atoms | 12 |
| Complexity | 170.0 |
| SMILES | CC(=O)C1=C(C=CC=C1F)OC |
| InChIKey | POHCKHGBDOTACV-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2'-Fluoro-6'-methoxyacetophenone. With a topological polar surface area (TPSA) of 26.3 Ų, 2'-Fluoro-6'-methoxyacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2'-Fluoro-6'-methoxyacetophenone has 0 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 2'-Fluoro-6'-methoxyacetophenone is 120484-50-6.
The molecular formula of 2'-Fluoro-6'-methoxyacetophenone is C9H9FO2.
The molecular weight of 2'-Fluoro-6'-methoxyacetophenone is 168.05865 g/mol.
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