TL;DR: 1,3-Dioxolane-4-methanol, 2-(p-methoxyphenyl)-2-methyl- (CAS 100257-80-5) is a chemical compound with molecular formula C12H16O4 and molecular weight 224.10486 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(4-methoxyphenyl)-2-methyl-1,3-dioxolan-4-yl]methanol
Also Known As: 2-(p-Methoxyphenyl)-2-methyl-1,3-dioxolane-4-methanol, [2-(4-methoxyphenyl)-2-methyl-1,3-dioxolan-4-yl]methanol, 1,3-DIOXOLANE-4-METHANOL, 2-(p-METHOXYPHENYL)-2-METHYL-, 3-methoxy-2-methoxymethyl-1-phenyl-propan-1-one
| Molecular Formula | C12H16O4 |
| Molecular Weight | 224.10486 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 47.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 224.10486 Da |
| Heavy Atoms | 16 |
| Complexity | 225.0 |
| SMILES | CC1(OCC(O1)CO)C2=CC=C(C=C2)OC |
| InChIKey | FDYCIYORWVHQEQ-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dioxolane-4-methanol, 2-(p-methoxyphenyl)-2-methyl-. With a topological polar surface area (TPSA) of 47.9 Ų, 1,3-Dioxolane-4-methanol, 2-(p-methoxyphenyl)-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxolane-4-methanol, 2-(p-methoxyphenyl)-2-methyl- has 1 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 1,3-Dioxolane-4-methanol, 2-(p-methoxyphenyl)-2-methyl- is 100257-80-5.
The molecular formula of 1,3-Dioxolane-4-methanol, 2-(p-methoxyphenyl)-2-methyl- is C12H16O4.
The molecular weight of 1,3-Dioxolane-4-methanol, 2-(p-methoxyphenyl)-2-methyl- is 224.10486 g/mol.
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