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| Related CAS: | 1115-11-3 (cis/trans mixture) |
| IUPAC Name: | (E)-2-methylbut-2-enal |
| Description: | Tiglic aldehyde is a reagent used in the synthesis of a cell adhesion inhibitor Peribysin E analog. It is also used in the preparation of thiolactomycin-based KasA inhibitors in the treatment of tuberculosis. |
| Molecular Weight: | 84.12 |
| Molecular Formula: | C5H8O |
| Canonical SMILES: | O=CC(=CC)C |
| InChI: | InChI=1S/C2H4.3CH4.H2O/c1-2;;;;/h1-2H2;3*1H4;1H2 |
| InChI Key: | SCULPRIXYTUBLZ-UHFFFAOYSA-N |
| Boiling Point: | 117 °C |
| Purity: | 95 % |
| Density: | 0.871 g/cm3 |
| Solubility: | Slightly soluble in water; soluble in ether and most oils |
| Appearance: | Clear colorless to yellow liquid |
| Storage: | Flammables area |
| LogP: | 1.15150 |
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1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
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