2-(4-butoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(4-butoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
2-(4-butoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3406-0075 |
| Compound Name: | 2-(4-butoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione |
| Molecular Weight: | 325.41 |
| Molecular Formula: | C20 H23 N O3 |
| Smiles: | CCCCOc1ccc(cc1)N1C(C2C3CCC(C=C3)C2C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4015 |
| logD: | 3.4015 |
| logSw: | -3.5186 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.41 |
| InChI Key: | AVGZVQCGHBYCKO-UHFFFAOYSA-N |