2-[3-(trifluoromethyl)phenyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[3-(trifluoromethyl)phenyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
2-[3-(trifluoromethyl)phenyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 5135-0041 |
| Compound Name: | 2-[3-(trifluoromethyl)phenyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione |
| Molecular Weight: | 307.27 |
| Molecular Formula: | C16 H12 F3 N O2 |
| Smiles: | C1C2C=CC1C1C2C(N(C1=O)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.4592 |
| logD: | 2.4592 |
| logSw: | -2.6381 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.7245 |
| InChI Key: | BYXMVCRHLWBFFG-UHFFFAOYSA-N |