3-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-3-oxopropanenitrile
Chemical Structure Depiction of
3-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-3-oxopropanenitrile
3-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-3-oxopropanenitrile
Compound characteristics
| Compound ID: | Y504-8998 |
| Compound Name: | 3-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-3-oxopropanenitrile |
| Molecular Weight: | 177.2 |
| Molecular Formula: | C9 H11 N3 O |
| Smiles: | CCn1cc(C(CC#N)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.1185 |
| logD: | -0.9406 |
| logSw: | -0.9578 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 45.832 |
| InChI Key: | JRKFADHZJKUUBY-UHFFFAOYSA-N |