4-[(3-chloro-4-nitrophenyl)methylidene]-2-methyl-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(3-chloro-4-nitrophenyl)methylidene]-2-methyl-1,3-oxazol-5(4H)-one
4-[(3-chloro-4-nitrophenyl)methylidene]-2-methyl-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 8014-8462 |
| Compound Name: | 4-[(3-chloro-4-nitrophenyl)methylidene]-2-methyl-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 266.64 |
| Molecular Formula: | C11 H7 Cl N2 O4 |
| Smiles: | CC1=NC(=C/c2ccc(c(c2)[Cl])[N+]([O-])=O)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 2.4946 |
| logD: | 2.4946 |
| logSw: | -3.4132 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.949 |
| InChI Key: | ZOCYSNYYONVPFT-UHFFFAOYSA-N |