3-(2-oxocyclohexyl)propanenitrile
Chemical Structure Depiction of
3-(2-oxocyclohexyl)propanenitrile
3-(2-oxocyclohexyl)propanenitrile
Compound characteristics
| Compound ID: | R062-0012 |
| Compound Name: | 3-(2-oxocyclohexyl)propanenitrile |
| Molecular Weight: | 151.21 |
| Molecular Formula: | C9 H13 N O |
| Smiles: | C1CCC(C(C1)CCC#N)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9774 |
| logD: | 0.9774 |
| logSw: | -1.0112 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 31.1703 |
| InChI Key: | SPTVCXKSSRBTMN-MRVPVSSYSA-N |