TL;DR: [(E)-2-diethoxyphosphoryl-2-fluoroethenyl]benzene (CAS 154092-27-0) is a chemical compound with molecular formula C12H16FO3P and molecular weight 258.08212 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]benzene
Also Known As: diethyl (Z)-(1-fluoro-2-phenylvinyl)phosphonate, Diethyl 1-fluoro-2-phenylvinylphosphonate, [(E)-2-diethoxyphosphoryl-2-fluoroethenyl]benzene, [(E)-2-diethoxyphosphoryl-2-fluoro-vinyl]benzene, diethyl [(1E)-1-fluoro-2-phenylethenyl]phosphonate
| Molecular Formula | C12H16FO3P |
| Molecular Weight | 258.08212 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 258.08212 Da |
| Heavy Atoms | 17 |
| Complexity | 288.0 |
| SMILES | CCOP(=O)(/C(=C/C1=CC=CC=C1)/F)OCC |
| InChIKey | VUAMDAUEABLOIX-ZRDIBKRKSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(E)-2-diethoxyphosphoryl-2-fluoroethenyl]benzene. With a topological polar surface area (TPSA) of 35.5 Ų, [(E)-2-diethoxyphosphoryl-2-fluoroethenyl]benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(E)-2-diethoxyphosphoryl-2-fluoroethenyl]benzene has 0 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 [(E)-2-diethoxyphosphoryl-2-fluoroethenyl]benzene is 154092-27-0.
The molecular formula of [(E)-2-diethoxyphosphoryl-2-fluoroethenyl]benzene is C12H16FO3P.
The molecular weight of [(E)-2-diethoxyphosphoryl-2-fluoroethenyl]benzene is 258.08212 g/mol.
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