2,2'-({4-methoxy-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}methylene)bis(5,5-dimethylcyclohexane-1,3-dione)
Chemical Structure Depiction of
2,2'-({4-methoxy-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}methylene)bis(5,5-dimethylcyclohexane-1,3-dione)
2,2'-({4-methoxy-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}methylene)bis(5,5-dimethylcyclohexane-1,3-dione)
Compound characteristics
| Compound ID: | 6049-1348 |
| Compound Name: | 2,2'-({4-methoxy-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}methylene)bis(5,5-dimethylcyclohexane-1,3-dione) |
| Molecular Weight: | 510.55 |
| Molecular Formula: | C27 H33 F3 O6 |
| Smiles: | CC1(C)CC(C(C(C2C(CC(C)(C)CC2=O)=O)c2ccc(c(COCC(F)(F)F)c2)OC)C(C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5098 |
| logD: | -1.9368 |
| logSw: | -3.6008 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 69.136 |
| InChI Key: | VUVBMRFFLDJIKB-UHFFFAOYSA-N |