3-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-4-oxopentanoic acid
Chemical Structure Depiction of
3-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-4-oxopentanoic acid
3-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-4-oxopentanoic acid
Compound characteristics
| Compound ID: | 8011-6566 |
| Compound Name: | 3-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-4-oxopentanoic acid |
| Molecular Weight: | 254.28 |
| Molecular Formula: | C13 H18 O5 |
| Smiles: | CC(C(CC(O)=O)C1=C(CC(C)(C)CC1=O)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.0975 |
| logD: | -2.6842 |
| logSw: | -0.1277 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.066 |
| InChI Key: | JSHYQFFZRQCDTK-QMMMGPOBSA-N |