4,4-dimethyl-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)pent-1-en-3-one
Chemical Structure Depiction of
4,4-dimethyl-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)pent-1-en-3-one
4,4-dimethyl-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)pent-1-en-3-one
Compound characteristics
| Compound ID: | 8005-2216 |
| Compound Name: | 4,4-dimethyl-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)pent-1-en-3-one |
| Molecular Weight: | 220.31 |
| Molecular Formula: | C13 H20 N2 O |
| Smiles: | Cc1c(/C=C/C(C(C)(C)C)=O)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.9017 |
| logD: | 1.9017 |
| logSw: | -1.8014 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 28.3247 |
| InChI Key: | MIRFYIGEETVNMM-BQYQJAHWSA-N |