3-{3-[2-(difluoromethoxy)phenyl]prop-2-enoyl}-4-hydroxy-6-methyl-2H-pyran-2-one
Chemical Structure Depiction of
3-{3-[2-(difluoromethoxy)phenyl]prop-2-enoyl}-4-hydroxy-6-methyl-2H-pyran-2-one
3-{3-[2-(difluoromethoxy)phenyl]prop-2-enoyl}-4-hydroxy-6-methyl-2H-pyran-2-one
Compound characteristics
| Compound ID: | Y505-2486 |
| Compound Name: | 3-{3-[2-(difluoromethoxy)phenyl]prop-2-enoyl}-4-hydroxy-6-methyl-2H-pyran-2-one |
| Molecular Weight: | 322.26 |
| Molecular Formula: | C16 H12 F2 O5 |
| Smiles: | CC1=CC(=C(C(/C=C/c2ccccc2OC(F)F)=O)C(=O)O1)O |
| Stereo: | ACHIRAL |
| logP: | 2.4514 |
| logD: | -2.9051 |
| logSw: | -2.6591 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.81 |
| InChI Key: | QBZOTVMBACZJAH-UHFFFAOYSA-N |