4,5-dimethyl-2-(2-methylphenyl)-3-oxo-1,3lambda~5~-oxazole--hydrogen chloride (1/1)
Chemical Structure Depiction of
4,5-dimethyl-2-(2-methylphenyl)-3-oxo-1,3lambda~5~-oxazole--hydrogen chloride (1/1)
4,5-dimethyl-2-(2-methylphenyl)-3-oxo-1,3lambda~5~-oxazole--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | K780-0431 |
| Compound Name: | 4,5-dimethyl-2-(2-methylphenyl)-3-oxo-1,3lambda~5~-oxazole--hydrogen chloride (1/1) |
| Molecular Weight: | 239.7 |
| Molecular Formula: | C12 H13 N O2 |
| Salt: | HCl |
| Smiles: | Cc1ccccc1c1[n+](c(C)c(C)o1)[O-] |
| Stereo: | ACHIRAL |
| logP: | 2.5387 |
| logD: | 2.5387 |
| logSw: | -2.6371 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 26.7401 |
| InChI Key: | TYQIQQQOKTXPNI-UHFFFAOYSA-N |