methyl [3-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenoxy]acetate
Chemical Structure Depiction of
methyl [3-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenoxy]acetate
methyl [3-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenoxy]acetate
Compound characteristics
| Compound ID: | 8009-6491 |
| Compound Name: | methyl [3-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenoxy]acetate |
| Molecular Weight: | 438.52 |
| Molecular Formula: | C26 H30 O6 |
| Smiles: | CC1(C)CC2=C(C(C3=C(CC(C)(C)CC3=O)O2)c2cccc(c2)OCC(=O)OC)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3639 |
| logD: | 3.3639 |
| logSw: | -3.5917 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.475 |
| InChI Key: | WNJAEDJXPOFFGA-UHFFFAOYSA-N |