2-(3-chlorophenyl)-4,5-dimethyl-3-oxo-1,3lambda~5~-oxazole--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-(3-chlorophenyl)-4,5-dimethyl-3-oxo-1,3lambda~5~-oxazole--hydrogen chloride (1/1)
2-(3-chlorophenyl)-4,5-dimethyl-3-oxo-1,3lambda~5~-oxazole--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | K780-0576 |
| Compound Name: | 2-(3-chlorophenyl)-4,5-dimethyl-3-oxo-1,3lambda~5~-oxazole--hydrogen chloride (1/1) |
| Molecular Weight: | 260.12 |
| Molecular Formula: | C11 H10 Cl N O2 |
| Salt: | HCl |
| Smiles: | Cc1c(C)oc(c2cccc(c2)[Cl])[n+]1[O-] |
| Stereo: | ACHIRAL |
| logP: | 2.9424 |
| logD: | 2.9424 |
| logSw: | -3.4793 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 26.7401 |
| InChI Key: | UJUXYRRHXSUHPG-UHFFFAOYSA-N |