4-(4-methylphenyl)-4-oxobut-2-enoic acid
Chemical Structure Depiction of
4-(4-methylphenyl)-4-oxobut-2-enoic acid
4-(4-methylphenyl)-4-oxobut-2-enoic acid
Compound characteristics
Compound ID: | 8005-8400 |
Compound Name: | 4-(4-methylphenyl)-4-oxobut-2-enoic acid |
Molecular Weight: | 190.2 |
Molecular Formula: | C11 H10 O3 |
Smiles: | Cc1ccc(cc1)C(/C=C/C(O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.0037 |
logD: | -3.4482 |
logSw: | -2.2232 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 41.869 |
InChI Key: | VNJMEFZKYZHWEO-UHFFFAOYSA-N |