9-(acetyloxy)-8,8-dimethyl-2-oxo-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-10-yl 2,3-dimethyloxirane-2-carboxylate
Chemical Structure Depiction of
9-(acetyloxy)-8,8-dimethyl-2-oxo-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-10-yl 2,3-dimethyloxirane-2-carboxylate
9-(acetyloxy)-8,8-dimethyl-2-oxo-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-10-yl 2,3-dimethyloxirane-2-carboxylate
Compound characteristics
| Compound ID: | N005-0005 |
| Compound Name: | 9-(acetyloxy)-8,8-dimethyl-2-oxo-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-10-yl 2,3-dimethyloxirane-2-carboxylate |
| Molecular Weight: | 402.4 |
| Molecular Formula: | C21 H22 O8 |
| Smiles: | CC1C(C)(C(=O)OC2C(C(C)(C)Oc3ccc4C=CC(=O)Oc4c23)OC(C)=O)O1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6994 |
| logD: | 2.6994 |
| logSw: | -2.8916 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 75.277 |
| InChI Key: | LNVSQOCOMICZRK-UHFFFAOYSA-N |