4-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-methoxyphenyl hexanoate
Chemical Structure Depiction of
4-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-methoxyphenyl hexanoate
4-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-methoxyphenyl hexanoate
Compound characteristics
| Compound ID: | 8014-7723 |
| Compound Name: | 4-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-methoxyphenyl hexanoate |
| Molecular Weight: | 438.52 |
| Molecular Formula: | C26 H30 O6 |
| Smiles: | CCCCCC(=O)Oc1ccc(cc1OC)C1C2=C(CCCC2=O)OC2CCCC(C1=2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4244 |
| logD: | 4.4244 |
| logSw: | -4.5468 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.169 |
| InChI Key: | PCDCDSFRCUGVSZ-UHFFFAOYSA-N |