3-(2-chlorophenyl)-2-cyanoprop-2-enoic acid
Chemical Structure Depiction of
3-(2-chlorophenyl)-2-cyanoprop-2-enoic acid
3-(2-chlorophenyl)-2-cyanoprop-2-enoic acid
Compound characteristics
| Compound ID: | 8020-6733 |
| Compound Name: | 3-(2-chlorophenyl)-2-cyanoprop-2-enoic acid |
| Molecular Weight: | 207.61 |
| Molecular Formula: | C10 H6 Cl N O2 |
| Smiles: | C(=C(/C#N)C(O)=O)/c1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.7893 |
| logD: | -5.1357 |
| logSw: | -2.2501 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.703 |
| InChI Key: | SPTXWNXTYIDOON-UHFFFAOYSA-N |