4,4-dimethyl-2-(2-methyl-3-nitrophenyl)-4,5-dihydro-1,3-oxazole
Chemical Structure Depiction of
4,4-dimethyl-2-(2-methyl-3-nitrophenyl)-4,5-dihydro-1,3-oxazole
4,4-dimethyl-2-(2-methyl-3-nitrophenyl)-4,5-dihydro-1,3-oxazole
Compound characteristics
| Compound ID: | 4802-0070 |
| Compound Name: | 4,4-dimethyl-2-(2-methyl-3-nitrophenyl)-4,5-dihydro-1,3-oxazole |
| Molecular Weight: | 234.25 |
| Molecular Formula: | C12 H14 N2 O3 |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)C1=NC(C)(C)CO1 |
| Stereo: | ACHIRAL |
| logP: | 2.547 |
| logD: | 2.5469 |
| logSw: | -2.7415 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.195 |
| InChI Key: | JKBQEJQMTASJLJ-UHFFFAOYSA-N |