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| IUPAC Name: | 3-oxo-N-phenylbutanamide |
| Description: | Acetoacetanilide can be used to synthesize organic compounds such as bicyclo[3.3.1]nonane derivatives and 6-aryl-2-methyl-4-oxo-N,N'-diphenyl-2-cyclohexene-1,3-dicarboxamides. |
| Molecular Weight: | 177.20 |
| Molecular Formula: | C10H11NO2 |
| Canonical SMILES: | CC(=O)CC(=O)NC1=CC=CC=C1 |
| InChI: | InChI=1S/C10H11NO2/c1-8(12)7-10(13)11-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,11,13) |
| InChI Key: | DYRDKSSFIWVSNM-UHFFFAOYSA-N |
| Boiling Point: | 373.3 °C at 760 mmHg |
| Melting Point: | 83-86 °C |
| Flash Point: | 325 °F |
| Purity: | 98 % |
| Density: | 1.26 g/cm3 |
| Appearance: | White crystalline solid. |
| Storage: | Keep container closed when not in use. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
| Decomposition: | See aniline. ...When heated to decomp, It emits highly toxic fumes. /aniline/ |
| MDL: | MFCD00008780 |
| LogP: | 1.67720 |
| Stability: | Enol form is unstable |
| Vapor Pressure: | 0.01 mmHg at 68 °F |
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1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
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