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Ethyl 4-(3-Nitrophenyl)-2,4-Dioxobutanoate CAS NO 57961-49-6
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CAS No.:57961-49-6
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
Ethyl 4-(3-Nitrophenyl)-2,4-Dioxobutanoate is a specialized organic compound featuring a β-diketone ester moiety linked to a nitrophenyl group, making it a valuable synthetic intermediate. This structure is crucial for constructing complex molecules in advanced chemical synthesis, particularly in pharmaceutical research and development. It is primarily sought by R&D chemists and process development scientists in the pharmaceutical, agrochemical, and fine chemical industries for the synthesis of active pharmaceutical ingredients (APIs) and other high-value heterocyclic compounds.
Application
- Pharmaceutical Intermediate: A key building block in the synthesis of complex drug candidates, particularly those containing fused heterocyclic systems.
- Agrochemical Synthesis: Used in research for developing novel herbicides, fungicides, and insecticides that require specific nitrophenyl-substituted structures.
- Fine Chemical Production: Serves as a precursor for dyes, pigments, and advanced organic materials where the nitro and diketone functionalities are essential.
- Academic & Industrial Research: Employed in methodological studies and as a model substrate for developing new organic reactions, such as cyclocondensations.
- Coordination Chemistry: The β-diketone moiety can act as a ligand for metal ions, useful in creating catalysts or metal-organic frameworks (MOFs).
Basic Information
| Product Name | Ethyl 4-(3-Nitrophenyl)-2,4-Dioxobutanoate |
| CAS No. | 57961-49-6 |
| Molecular Formula | C₁₂H₁₁NO₆ |
| Molecular Weight | 265.22 g/mol |
| Synonyms | Ethyl 3-(3-nitrobenzoyl)pyruvate; 4-(3-Nitrophenyl)-2,4-dioxobutanoic acid ethyl ester; 3-Nitrobenzoylpyruvic acid ethyl ester; Ethyl (3-nitrobenzoyl)pyruvate; Ethyl 4-(3-nitrophenyl)-2,4-dioxobutanoate; 2,4-Dioxo-4-(3-nitrophenyl)butyric acid ethyl ester; 1-Ethoxy-1,3-bis(3-nitrophenyl)-1,3-propanedione (tautomeric form); Ethyl β-(3-nitrobenzoyl)pyruvate |
| EINECS | Contact for details |
Quality Control
Our production of Ethyl 4-(3-Nitrophenyl)-2,4-Dioxobutanoate adheres to stringent quality protocols to ensure batch-to-batch consistency and high purity suitable for research and development. Each lot is analyzed using advanced techniques including HPLC, GC, and NMR spectroscopy. A comprehensive Certificate of Analysis (COA) detailing purity, identity, and impurity profiles is provided with every shipment to support your quality assurance and regulatory documentation needs.
Storage
Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (typically 15-25°C). Keep away from heat, sparks, and open flame. Due to its light-sensitive nature, the container should be opaque or stored in a dark place.
Specification
| Item | Specification |
|---|---|
| Appearance | Yellow to orange crystalline powder |
| Identification (IR) | Conforms to structure |
| Purity (HPLC) | ≥ 97.0% |
| Melting Point | Contact for details |
| Loss on Drying | ≤ 0.5% |
| Residue on Ignition | ≤ 0.1% |
| Heavy Metals (as Pb) | ≤ 20 ppm |
Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.
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