benzyl [(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
Chemical Structure Depiction of
benzyl [(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
benzyl [(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
Compound characteristics
| Compound ID: | 3330-4356 |
| Compound Name: | benzyl [(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate |
| Molecular Weight: | 350.37 |
| Molecular Formula: | C21 H18 O5 |
| Smiles: | C1CC2=C(C1)c1ccc(cc1OC2=O)OCC(=O)OCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4263 |
| logD: | 3.4263 |
| logSw: | -3.7685 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.208 |
| InChI Key: | ZIPNABLDUWDTGG-UHFFFAOYSA-N |