5(4H)-Oxazolone, 2-methyl-4-[(3-nitrophenyl)methylene]-
2-methyl-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5-one
Also Known As: Maybridge1_000122|2,4,6-tribromo-thiophenol|MixCom1_000232|5(4H)-Oxazolone, 2-methyl-4-[(3-nitrophenyl)methylene]-|2-methyl-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5-one|NCI60_010063|2-methyl-4-(3-nitrobenzylidene)oxazol-5(4H)-one|2-Methyl-4-[(3-nitrophenyl)methylene]-5(4H)-Oxazolone|(4Z)-2-methyl-4-[(3-nitrophenyl)methylene]oxazol-5-one|(4Z)-2-methyl-4-[(3-nitrophenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one|2-Methyl-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one|2-methyl-4-[(3-nitrophenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one
| Molecular Formula | C11H8N2O4 |
|---|---|
| Molecular Weight | 232.0484 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 232.0484 |
| Monoisotopic Mass | 232.0484 |
| Heavy Atoms | 17 |
| Complexity | 408.0 |
Chemical Identifiers
| CAS Number | 57731-07-4 |
|---|---|
| SMILES | CC1=NC(=CC2=CC(=CC=C2)[N+](=O)[O-])C(=O)O1 |
| InChIKey | ABNNCLKVUMXLSZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5(4H)-Oxazolone, 2-methyl-4-[(3-nitrophenyl)methylene]- (CAS 57731-07-4), with molecular formula C11H8N2O4 and molecular weight 232.0484 g/mol. IUPAC: 2-methyl-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5-one.