3-(2-ethyl-2-methyloxan-4-yl)-3-(4-methylphenyl)propanenitrile
Chemical Structure Depiction of
3-(2-ethyl-2-methyloxan-4-yl)-3-(4-methylphenyl)propanenitrile
3-(2-ethyl-2-methyloxan-4-yl)-3-(4-methylphenyl)propanenitrile
Compound characteristics
| Compound ID: | 3683-0569 |
| Compound Name: | 3-(2-ethyl-2-methyloxan-4-yl)-3-(4-methylphenyl)propanenitrile |
| Molecular Weight: | 271.4 |
| Molecular Formula: | C18 H25 N O |
| Smiles: | CCC1(C)CC(CCO1)C(CC#N)c1ccc(C)cc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2014 |
| logD: | 4.2014 |
| logSw: | -4.2939 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 25.0442 |
| InChI Key: | RCNRIJFAHRFLDF-UHFFFAOYSA-N |