5-methyl-2-phenyl-1,3-dioxane-5-carboxylic acid
Chemical Structure Depiction of
5-methyl-2-phenyl-1,3-dioxane-5-carboxylic acid
5-methyl-2-phenyl-1,3-dioxane-5-carboxylic acid
Compound characteristics
| Compound ID: | 8011-9637 |
| Compound Name: | 5-methyl-2-phenyl-1,3-dioxane-5-carboxylic acid |
| Molecular Weight: | 222.24 |
| Molecular Formula: | C12 H14 O4 |
| Smiles: | CC1(COC(c2ccccc2)OC1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4174 |
| logD: | -1.0452 |
| logSw: | -1.3444 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.059 |
| InChI Key: | WDSCTZOPHREENN-UHFFFAOYSA-N |