2-(4-methoxyphenyl)-5-methyl-1,3-dioxane-5-carboxylic acid
Chemical Structure Depiction of
2-(4-methoxyphenyl)-5-methyl-1,3-dioxane-5-carboxylic acid
2-(4-methoxyphenyl)-5-methyl-1,3-dioxane-5-carboxylic acid
Compound characteristics
| Compound ID: | 8011-5996 |
| Compound Name: | 2-(4-methoxyphenyl)-5-methyl-1,3-dioxane-5-carboxylic acid |
| Molecular Weight: | 252.26 |
| Molecular Formula: | C13 H16 O5 |
| Smiles: | CC1(COC(c2ccc(cc2)OC)OC1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3955 |
| logD: | -1.0671 |
| logSw: | -1.4894 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.602 |
| InChI Key: | KGWLYWQUODVETH-UHFFFAOYSA-N |