TL;DR: 1-(5-Butoxy-2-hydroxyphenyl)ethanone (CAS 152810-06-5) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.10994 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(5-butoxy-2-hydroxyphenyl)ethanone
Also Known As: 1-(5-butoxy-2-hydroxyphenyl)ethan-1-one, 1-(5-butoxy-2-hydroxyphenyl)ethanone, 1-acetyl-5-butoxy-2-hydroxybenzene, Ethanone, 1-(5-butoxy-2-hydroxyphenyl)-, AB00076159-01
| Molecular Formula | C12H16O3 |
| Molecular Weight | 208.10994 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 208.10994 Da |
| Heavy Atoms | 15 |
| Complexity | 203.0 |
| SMILES | CCCCOC1=CC(=C(C=C1)O)C(=O)C |
| InChIKey | WFMGVLPLMIMMOY-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 1-(5-Butoxy-2-hydroxyphenyl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 1-(5-Butoxy-2-hydroxyphenyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Butoxy-2-hydroxyphenyl)ethanone has 1 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 1-(5-Butoxy-2-hydroxyphenyl)ethanone is 152810-06-5.
The molecular formula of 1-(5-Butoxy-2-hydroxyphenyl)ethanone is C12H16O3.
The molecular weight of 1-(5-Butoxy-2-hydroxyphenyl)ethanone is 208.10994 g/mol.
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