9-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Chemical Structure Depiction of
9-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
9-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Compound characteristics
| Compound ID: | 8007-0750 |
| Compound Name: | 9-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione |
| Molecular Weight: | 436.55 |
| Molecular Formula: | C27 H32 O5 |
| Smiles: | CC1(C)CC2=C(C(C3=C(CC(C)(C)CC3=O)O2)c2ccc(c(c2)OC)OCC=C)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5225 |
| logD: | 4.5225 |
| logSw: | -4.6239 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.532 |
| InChI Key: | HVIFNIJXFXKMIU-UHFFFAOYSA-N |