3-(1,3-dimethyl-1H-pyrazol-4-yl)-3-oxopropanenitrile
Chemical Structure Depiction of
3-(1,3-dimethyl-1H-pyrazol-4-yl)-3-oxopropanenitrile
3-(1,3-dimethyl-1H-pyrazol-4-yl)-3-oxopropanenitrile
Compound characteristics
| Compound ID: | Y507-4708 |
| Compound Name: | 3-(1,3-dimethyl-1H-pyrazol-4-yl)-3-oxopropanenitrile |
| Molecular Weight: | 163.18 |
| Molecular Formula: | C8 H9 N3 O |
| Smiles: | Cc1c(cn(C)n1)C(CC#N)=O |
| Stereo: | ACHIRAL |
| logP: | -0.296 |
| logD: | -1.3552 |
| logSw: | -0.7701 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 46.139 |
| InChI Key: | GMTLYBFXAHGMAZ-UHFFFAOYSA-N |