HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-(3,4-dichlorophenyl)-3a,4,7,7a-tetrahydro-1H-spiro[2-aza-4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione
4-(3,4-dichlorophenyl)-spiro[4-azatricyclo[5.2.1.0~2,6~]dec[8]ene-10,1'-cyclopropane]-3,5-dione
![2-(3,4-dichlorophenyl)-3a,4,7,7a-tetrahydro-1H-spiro[2-aza-4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione molecular structure](/img/chemical/178819833.png)
Identifiers & Physical Properties
| CAS No. | 426837-20-9 |
|---|---|
| Molecular formula | C17H13Cl2NO2 |
| Average molar mass | 334.2 g/mol |
| SMILES | O=C1C2C(C(=O)N1c1ccc(Cl)c(Cl)c1)C1C=CC2C12CC2 |
| InChIKey | LYQGQFOGIJZQNF-UHFFFAOYSA-N |
Chemical & Physical Properties
| XLogP | 3.5 |
|---|---|
| Topological polar surface area | 37.4 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 1 |
| Heavy atoms | 22 |
| Formal charge | 0 |
| Complexity | 565 |