1-[3,5-dimethyl-1-(propan-2-yl)-1H-pyrazol-4-yl]ethan-1-one
Chemical Structure Depiction of
1-[3,5-dimethyl-1-(propan-2-yl)-1H-pyrazol-4-yl]ethan-1-one
1-[3,5-dimethyl-1-(propan-2-yl)-1H-pyrazol-4-yl]ethan-1-one
Compound characteristics
| Compound ID: | IB09-1975 |
| Compound Name: | 1-[3,5-dimethyl-1-(propan-2-yl)-1H-pyrazol-4-yl]ethan-1-one |
| Molecular Weight: | 180.25 |
| Molecular Formula: | C10 H16 N2 O |
| Smiles: | CC(C)n1c(C)c(C(C)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.22 |
| logD: | 1.22 |
| logSw: | -1.51 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 56.37 |
| InChI Key: | BJYVVHKNACUSFK-UHFFFAOYSA-N |