4-nitro-5-[2-oxo-2-(thiophen-2-yl)ethyl]benzene-1,2-dicarbonitrile
Chemical Structure Depiction of
4-nitro-5-[2-oxo-2-(thiophen-2-yl)ethyl]benzene-1,2-dicarbonitrile
4-nitro-5-[2-oxo-2-(thiophen-2-yl)ethyl]benzene-1,2-dicarbonitrile
Compound characteristics
| Compound ID: | 8020-2230 |
| Compound Name: | 4-nitro-5-[2-oxo-2-(thiophen-2-yl)ethyl]benzene-1,2-dicarbonitrile |
| Molecular Weight: | 297.29 |
| Molecular Formula: | C14 H7 N3 O3 S |
| Smiles: | C(C(c1cccs1)=O)c1cc(C#N)c(C#N)cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8965 |
| logD: | 2.8965 |
| logSw: | -3.6473 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 81.425 |
| InChI Key: | ZWHUUCMKTSFQOL-UHFFFAOYSA-N |