2,2,2-trifluoro-1-[5-hydroxy-3-methyl-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
2,2,2-trifluoro-1-[5-hydroxy-3-methyl-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2,2,2-trifluoro-1-[5-hydroxy-3-methyl-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8006-5571 |
| Compound Name: | 2,2,2-trifluoro-1-[5-hydroxy-3-methyl-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 317.22 |
| Molecular Formula: | C12 H10 F3 N3 O4 |
| Smiles: | CC1CC(c2cccc(c2)[N+]([O-])=O)(N(C(C(F)(F)F)=O)N=1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0745 |
| logD: | 2.0745 |
| logSw: | -2.2627 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.344 |
| InChI Key: | RWOOLULWEDILJC-NSHDSACASA-N |