TL;DR: 1-(4-Dimethoxymethylphenyl)ethanone (CAS 166518-43-0) is a chemical compound with molecular formula C11H14O3 and molecular weight 194.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4-(dimethoxymethyl)phenyl]ethanone
Also Known As: 1-(4-dimethoxymethylphenyl)ethanone, 4 -(Dimethoxymethyl)acetophenone, 4-Acetylbenzaldehyde dimethyl acetal, 1-[4-(dimethoxymethyl)phenyl]ethanone, Ethanone,1-[4-(dimethoxymethyl)phenyl]-
| Molecular Formula | C11H14O3 |
| Molecular Weight | 194.0943 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 194.0943 Da |
| Heavy Atoms | 14 |
| Complexity | 179.0 |
| SMILES | CC(=O)C1=CC=C(C=C1)C(OC)OC |
| InChIKey | CGVIVIJQACBWNG-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Dimethoxymethylphenyl)ethanone. With a topological polar surface area (TPSA) of 35.5 Ų, 1-(4-Dimethoxymethylphenyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Dimethoxymethylphenyl)ethanone 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 1-(4-Dimethoxymethylphenyl)ethanone is 166518-43-0.
The molecular formula of 1-(4-Dimethoxymethylphenyl)ethanone is C11H14O3.
The molecular weight of 1-(4-Dimethoxymethylphenyl)ethanone is 194.0943 g/mol.
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