3-ethyl-5,5-dimethyl-6-phenyloxane-2,4-dione
Chemical Structure Depiction of
3-ethyl-5,5-dimethyl-6-phenyloxane-2,4-dione
3-ethyl-5,5-dimethyl-6-phenyloxane-2,4-dione
Compound characteristics
| Compound ID: | 8011-0818 |
| Compound Name: | 3-ethyl-5,5-dimethyl-6-phenyloxane-2,4-dione |
| Molecular Weight: | 246.3 |
| Molecular Formula: | C15 H18 O3 |
| Smiles: | [H]C1(CC)C(C(C)(C)C(c2ccccc2)OC1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3969 |
| logD: | 3.3947 |
| logSw: | -3.2801 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.825 |
| InChI Key: | BQISGOZGIFFRIQ-UHFFFAOYSA-N |