2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1-[4-(trifluoromethoxy)phenyl]-1,5,6,7-tetrahydro-4H-indol-4-one
Chemical Structure Depiction of
2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1-[4-(trifluoromethoxy)phenyl]-1,5,6,7-tetrahydro-4H-indol-4-one
2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1-[4-(trifluoromethoxy)phenyl]-1,5,6,7-tetrahydro-4H-indol-4-one
Compound characteristics
| Compound ID: | 8012-0483 |
| Compound Name: | 2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1-[4-(trifluoromethoxy)phenyl]-1,5,6,7-tetrahydro-4H-indol-4-one |
| Molecular Weight: | 468.73 |
| Molecular Formula: | C20 H19 Cl3 F3 N O2 |
| Smiles: | Cc1c(CC([Cl])([Cl])[Cl])c2C(CC(C)(C)Cc2n1c1ccc(cc1)OC(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6393 |
| logD: | 6.6393 |
| logSw: | -6.5203 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 21.7692 |
| InChI Key: | QLIYELUNTCONLN-UHFFFAOYSA-N |