4-[2-(3,5-dichloro-2-hydroxyphenyl)ethenyl]-5-nitrobenzene-1,2-dicarbonitrile
Chemical Structure Depiction of
4-[2-(3,5-dichloro-2-hydroxyphenyl)ethenyl]-5-nitrobenzene-1,2-dicarbonitrile
4-[2-(3,5-dichloro-2-hydroxyphenyl)ethenyl]-5-nitrobenzene-1,2-dicarbonitrile
Compound characteristics
| Compound ID: | 8020-5929 |
| Compound Name: | 4-[2-(3,5-dichloro-2-hydroxyphenyl)ethenyl]-5-nitrobenzene-1,2-dicarbonitrile |
| Molecular Weight: | 360.15 |
| Molecular Formula: | C16 H7 Cl2 N3 O3 |
| Smiles: | C(=C/c1cc(cc(c1O)[Cl])[Cl])\c1cc(C#N)c(C#N)cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8867 |
| logD: | 3.8627 |
| logSw: | -4.5255 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.639 |
| InChI Key: | KKAXDNITUTYOPZ-UHFFFAOYSA-N |