8,8-dimethyl-2-oxo-4-phenyl-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-5-yl propanoate
Chemical Structure Depiction of
8,8-dimethyl-2-oxo-4-phenyl-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-5-yl propanoate
8,8-dimethyl-2-oxo-4-phenyl-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-5-yl propanoate
Compound characteristics
| Compound ID: | Y040-3375 |
| Compound Name: | 8,8-dimethyl-2-oxo-4-phenyl-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-5-yl propanoate |
| Molecular Weight: | 378.42 |
| Molecular Formula: | C23 H22 O5 |
| Smiles: | CCC(=O)Oc1cc2c(CCC(C)(C)O2)c2c1C(=CC(=O)O2)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5438 |
| logD: | 4.5438 |
| logSw: | -4.6163 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.532 |
| InChI Key: | ZNOCMZFLGYRJQR-UHFFFAOYSA-N |