1,5-dimethyl-4-nitro-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
1,5-dimethyl-4-nitro-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
1,5-dimethyl-4-nitro-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8018-7197 |
| Compound Name: | 1,5-dimethyl-4-nitro-2-phenyl-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 233.22 |
| Molecular Formula: | C11 H11 N3 O3 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.7882 |
| logD: | 0.7882 |
| logSw: | -0.8851 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.72 |
| InChI Key: | JKNDILGGBVQHNT-UHFFFAOYSA-N |