4-cyanobenzoic acid
Chemical Structure Depiction of
4-cyanobenzoic acid
4-cyanobenzoic acid
Compound characteristics
| Compound ID: | 0584-0555 |
| Compound Name: | 4-cyanobenzoic acid |
| Molecular Weight: | 147.13 |
| Molecular Formula: | C8 H5 N O2 |
| Smiles: | C(c1ccc(cc1)C(O)=O)#N |
| Stereo: | ACHIRAL |
| logP: | 1.6925 |
| logD: | -2.1272 |
| logSw: | -1.8398 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.703 |
| InChI Key: | ADCUEPOHPCPMCE-UHFFFAOYSA-N |