[5-(heptadecafluorooctyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl](4-nitrophenyl)methanone
Chemical Structure Depiction of
[5-(heptadecafluorooctyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl](4-nitrophenyl)methanone
[5-(heptadecafluorooctyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl](4-nitrophenyl)methanone
Compound characteristics
| Compound ID: | 8008-0050 |
| Compound Name: | [5-(heptadecafluorooctyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl](4-nitrophenyl)methanone |
| Molecular Weight: | 667.28 |
| Molecular Formula: | C19 H10 F17 N3 O4 |
| Smiles: | CC1CC(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(N(C(c2ccc(cc2)[N+]([O-])=O)=O)N=1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0126 |
| logD: | 6.0126 |
| logSw: | -5.5045 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.344 |
| InChI Key: | URRAWQMQZDJDDX-NSHDSACASA-N |