TL;DR: 4-(tert-Butoxy)-2,3,5,6-tetrafluorostyrene (CAS 103008-51-1) is a chemical compound with molecular formula C12H12F4O and molecular weight 248.08243 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-ethenyl-2,3,5,6-tetrafluoro-4-[(2-methylpropan-2-yl)oxy]benzene
Also Known As: 4-(tert-Butoxy)-2,3,5,6-tetrafluorostyrene, 0942AE, 1-ethenyl-2,3,5,6-tetrafluoro-4-[(2-methylpropan-2-yl)oxy]benzene, 2,3,5,6-Tetrafluoro-4-tert-butoxystyrene, 2-(Trifluoromethoxy)benzenesulfonyl chloride
| Molecular Formula | C12H12F4O |
| Molecular Weight | 248.08243 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.08243 Da |
| Heavy Atoms | 17 |
| Complexity | 260.0 |
| SMILES | CC(C)(C)OC1=C(C(=C(C(=C1F)F)C=C)F)F |
| InChIKey | QRKPOBGCHDVVRQ-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that 4-(tert-Butoxy)-2,3,5,6-tetrafluorostyrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 4-(tert-Butoxy)-2,3,5,6-tetrafluorostyrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(tert-Butoxy)-2,3,5,6-tetrafluorostyrene has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(tert-Butoxy)-2,3,5,6-tetrafluorostyrene is 103008-51-1.
The molecular formula of 4-(tert-Butoxy)-2,3,5,6-tetrafluorostyrene is C12H12F4O.
The molecular weight of 4-(tert-Butoxy)-2,3,5,6-tetrafluorostyrene is 248.08243 g/mol.
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