3-oxo-2-phenylbutanenitrile
Chemical Structure Depiction of
3-oxo-2-phenylbutanenitrile
3-oxo-2-phenylbutanenitrile
Compound characteristics
| Compound ID: | 8011-6559 |
| Compound Name: | 3-oxo-2-phenylbutanenitrile |
| Molecular Weight: | 159.18 |
| Molecular Formula: | C10 H9 N O |
| Smiles: | CC(C(C#N)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6735 |
| logD: | 1.6722 |
| logSw: | -1.6749 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 31.1213 |
| InChI Key: | KHNWFTMUBKJWRZ-JTQLQIEISA-N |