2-(3,4-dimethylphenyl)-2-oxoethyl 2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-2-oxoethyl 2-oxo-2H-1-benzopyran-3-carboxylate
2-(3,4-dimethylphenyl)-2-oxoethyl 2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
Compound ID: | 2477-0634 |
Compound Name: | 2-(3,4-dimethylphenyl)-2-oxoethyl 2-oxo-2H-1-benzopyran-3-carboxylate |
Molecular Weight: | 336.34 |
Molecular Formula: | C20 H16 O5 |
Smiles: | Cc1ccc(cc1C)C(COC(C1=Cc2ccccc2OC1=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.8413 |
logD: | 3.8413 |
logSw: | -4.1367 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 55.265 |
InChI Key: | JOXKYAVHSRGZBY-UHFFFAOYSA-N |