4-(3,4-dimethylphenoxy)-5-nitrobenzene-1,2-dicarbonitrile
Chemical Structure Depiction of
4-(3,4-dimethylphenoxy)-5-nitrobenzene-1,2-dicarbonitrile
4-(3,4-dimethylphenoxy)-5-nitrobenzene-1,2-dicarbonitrile
Compound characteristics
| Compound ID: | 8009-9962 |
| Compound Name: | 4-(3,4-dimethylphenoxy)-5-nitrobenzene-1,2-dicarbonitrile |
| Molecular Weight: | 293.28 |
| Molecular Formula: | C16 H11 N3 O3 |
| Smiles: | Cc1ccc(cc1C)Oc1cc(C#N)c(C#N)cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9929 |
| logD: | 3.9929 |
| logSw: | -4.3199 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 74.266 |
| InChI Key: | USTUQXWWWYOXGR-UHFFFAOYSA-N |