| CAS: | 542-08-5 |
| MF: | C7H12O3 |
| MW: | 144.17 |
| EINECS: | 208-798-4 |
| Product Categories: | Miscellaneous Reagents;C6 to C7;Carbonyl Compounds;Esters;bc0001 |
| Mol File: | 542-08-5.mol |
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| Isopropyl acetoacetate Chemical Properties |
| Melting point | -27°C |
| Boiling point | 95 °C52 hPa(lit.) |
| density | 0.989 g/mL at 20 °C(lit.) |
| refractive index | n20/D 1.418 |
| Fp | 73°C |
| solubility | Chloroform, Ethyl Acetate, Methanol, Toluene, |
| pka | 11.67±0.46(Predicted) |
| form | Colourless Liquid |
| color | Colorless to Almost colorless |
| Water Solubility | Slightly miscible with water. |
| Merck | 14,5206 |
| BRN | 1757046 |
| InChIKey | GVIIRWAJDFKJMJ-UHFFFAOYSA-N |
| LogP | 1.060 (est) |
| CAS DataBase Reference | 542-08-5(CAS DataBase Reference) |
| EPA Substance Registry System | Butanoic acid, 3-oxo-, 1-methylethyl ester (542-08-5) |
| Isopropyl acetoacetate Usage And Synthesis |
| Chemical Properties | Colourless Liquid |
| Uses | Isopropyl acetoacetate (IPAA) is used as intermediate for chemical synthesis. Product Data Sheet |
| Uses | Isopropyl acetoacetate is used as an intermediate for the manufacturing of agrochemicals and pharmaceutical products such as isradipine. |
| Application | Isopropyl acetoacetate can be used as a reactant to synthesize:
Isopropyl 2-acetyl-3-phenyl-2-propenoate via Knoevenagel reaction in the presence of Ti(O-i-Pr)4.
Substituted 1,4-dihydropyridines by reacting with cinnamaldehydes and primary amines.
5-Isopropoxycarbonyl-6-methyl-4-phenyl-3,4-dihydropyrimidin-2(1H)-thione via Biginelli reaction with benzaldehyde and thiourea. |
| Synthesis Reference(s) | The Journal of Organic Chemistry, 26, p. 225, 1961 DOI: 10.1021/jo01060a055 |
Product picture
Packing &shipping&Payment
Packing:25kg/drum
Shipping:by sea or by air
Payment:T/T,western union,moneygram
Packaging Details drum
Port:Tianjin
Lead Time :
| Quantity(Kilograms) | 1 - 10000 | >10000 |
| Est. Time(days) | 5 | To be negotiated |
Company information
Hebei Mojin Biotechnology Co., Ltd, Our company is a professional in 4'-Methylacetophenone,Levamisole hydrochloride ,N-Methylformamide and other chemical reagents research and development production enterprises. Our business covers more than 30 countries, most of the big customers come from Europe, America and other countries in the world, we can guarantee the quality and price. In recent decades, with the efforts of all employees, we have established many cooperative companies in shandong, henan, guangdong and other places. Our corporate purpose is based on the market, enhance the strength, take the road of scientific and environmental sustainable development, relying on the country. Technology r & d center, increase the investment in r & d, based on the domestic market, expand the international market, manufacturing quality products, sincere service to the society, into a modern, ecological, scientific and technological enterprise world.
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