5,5-dimethyl-4-nitro-3-phenyl-4,5-dihydro-1,2-oxazole
Chemical Structure Depiction of
5,5-dimethyl-4-nitro-3-phenyl-4,5-dihydro-1,2-oxazole
5,5-dimethyl-4-nitro-3-phenyl-4,5-dihydro-1,2-oxazole
Compound characteristics
| Compound ID: | 8017-9261 |
| Compound Name: | 5,5-dimethyl-4-nitro-3-phenyl-4,5-dihydro-1,2-oxazole |
| Molecular Weight: | 220.22 |
| Molecular Formula: | C11 H12 N2 O3 |
| Smiles: | CC1(C)C(C(c2ccccc2)=NO1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2226 |
| logD: | 2.1796 |
| logSw: | -2.1301 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.943 |
| InChI Key: | QFENGDMXCZZCNK-SNVBAGLBSA-N |