2-(3-methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(3-methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
2-(3-methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3970-0923 |
| Compound Name: | 2-(3-methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione |
| Molecular Weight: | 267.33 |
| Molecular Formula: | C17 H17 N O2 |
| Smiles: | Cc1cccc(c1)N1C(C2C3CCC(C=C3)C2C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.4676 |
| logD: | 2.4676 |
| logSw: | -2.5376 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.9926 |
| InChI Key: | RVCXNTANVXVQIL-UHFFFAOYSA-N |