propan-2-yl 2-(4,5-dicyano-2-nitrophenoxy)benzoate
Chemical Structure Depiction of
propan-2-yl 2-(4,5-dicyano-2-nitrophenoxy)benzoate
propan-2-yl 2-(4,5-dicyano-2-nitrophenoxy)benzoate
Compound characteristics
| Compound ID: | 8016-3863 |
| Compound Name: | propan-2-yl 2-(4,5-dicyano-2-nitrophenoxy)benzoate |
| Molecular Weight: | 351.32 |
| Molecular Formula: | C18 H13 N3 O5 |
| Smiles: | CC(C)OC(c1ccccc1Oc1cc(C#N)c(C#N)cc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7457 |
| logD: | 3.7457 |
| logSw: | -4.1668 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 94.785 |
| InChI Key: | DCEVTTBQDKAKNB-UHFFFAOYSA-N |