2-(4-bromo-2-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(4-bromo-2-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
2-(4-bromo-2-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 1935-0154 |
| Compound Name: | 2-(4-bromo-2-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione |
| Molecular Weight: | 377.19 |
| Molecular Formula: | C16 H13 Br N2 O4 |
| Smiles: | C1CC2C=CC1C1C2C(N(C1=O)c1ccc(cc1[N+]([O-])=O)[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.64 |
| logD: | 2.64 |
| logSw: | -2.968 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.772 |
| InChI Key: | BPWMWNACLRHPAX-UHFFFAOYSA-N |