1,8-bis(3,5-dimethyl-1H-pyrazol-1-yl)octane-1,8-dione
Chemical Structure Depiction of
1,8-bis(3,5-dimethyl-1H-pyrazol-1-yl)octane-1,8-dione
1,8-bis(3,5-dimethyl-1H-pyrazol-1-yl)octane-1,8-dione
Compound characteristics
| Compound ID: | 5579-0115 |
| Compound Name: | 1,8-bis(3,5-dimethyl-1H-pyrazol-1-yl)octane-1,8-dione |
| Molecular Weight: | 330.43 |
| Molecular Formula: | C18 H26 N4 O2 |
| Smiles: | Cc1cc(C)n(C(CCCCCCC(n2c(C)cc(C)n2)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.311 |
| logD: | 1.311 |
| logSw: | -1.4439 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.59 |
| InChI Key: | XNQNFMWVDCPBDI-UHFFFAOYSA-N |