4-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-methoxyphenyl propanoate
Chemical Structure Depiction of
4-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-methoxyphenyl propanoate
4-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-methoxyphenyl propanoate
Compound characteristics
| Compound ID: | 8014-5363 |
| Compound Name: | 4-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-methoxyphenyl propanoate |
| Molecular Weight: | 396.44 |
| Molecular Formula: | C23 H24 O6 |
| Smiles: | CCC(=O)Oc1ccc(cc1OC)C1C2=C(CCCC2=O)OC2CCCC(C1=2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9857 |
| logD: | 2.9857 |
| logSw: | -3.3233 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.169 |
| InChI Key: | KQCACODCDAIUSV-UHFFFAOYSA-N |