5,6-dimethyl-2-[3-(trifluoromethyl)phenyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
5,6-dimethyl-2-[3-(trifluoromethyl)phenyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
5,6-dimethyl-2-[3-(trifluoromethyl)phenyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3387-0056 |
| Compound Name: | 5,6-dimethyl-2-[3-(trifluoromethyl)phenyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 323.31 |
| Molecular Formula: | C17 H16 F3 N O2 |
| Smiles: | CC1CC2C(CC=1C)C(N(C2=O)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1172 |
| logD: | 3.1172 |
| logSw: | -3.2629 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.072 |
| InChI Key: | AJQUBZOGUDYWCL-UHFFFAOYSA-N |