1-hydroxy-2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
Chemical Structure Depiction of
1-hydroxy-2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
1-hydroxy-2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
Compound characteristics
| Compound ID: | 8012-0477 |
| Compound Name: | 1-hydroxy-2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one |
| Molecular Weight: | 324.63 |
| Molecular Formula: | C13 H16 Cl3 N O2 |
| Smiles: | Cc1c(CC([Cl])([Cl])[Cl])c2C(CC(C)(C)Cc2n1O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.207 |
| logD: | 1.6856 |
| logSw: | -3.5128 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.45 |
| InChI Key: | JUAZIIXNHHYISS-UHFFFAOYSA-N |