559210

Ethyl (4-chlorobenzoyl)acetate

• Sinônimo(s): 3-(4-Chlorophenyl)-3-oxopropanoic acid ethyl ester, Ethyl 3-(4-chlorophenyl)-3-oxopropanoate, NSC 406743
• Fórmula linear: ClC₆H₄COCH₂CO₂C₂H₅
• Número CAS: 2881-63-2
• Peso molecular: 226.66
• Número MDL: MFCD00018713
• Código UNSPSC: 12352100
• ID de substância PubChem: 24879805
• NACRES: NA.22

Propriedades

• forma: solid
• Nível de qualidade: 100
• índice de refração: n20/D 1.5500 (lit.)
• pb: 268-269 °C (lit.)
• densidade: 1.218 g/mL at 25 °C (lit.)
• grupo funcional: chloro; ester; ketone
• cadeia de caracteres SMILES: CCOC(=O)CC(=O)c1ccc(Cl)cc1
• InChI: 1S/C11H11ClO3/c1-2-15-11(14)7-10(13)8-3-5-9(12)6-4-8/h3-6H,2,7H2,1H3
• chave InChI: DGCZHKABHPDNCC-UHFFFAOYSA-N

Descrição

Aplicação

Ethyl (4-chlorobenzoyl)acetate may be used to synthesize 2-(carboethoxy)-3-(4′-chloro)phenylquinoxaline 1,4-dioxide.

Reactant involved in:

• Tandem condensation-cyclization reactions
• Stereoselective ketonization-olefination of indoles
• Synthesis of antiplasmodial agents
• SIRT 1/2 inhibitor preparation for use as antitumor agents
• Synthesis of mineralocorticoid receptor antagonists
• Intramolecular Michael addition reactions

Informações de segurança

• Código de classe de armazenamento: 11 - Combustible Solids
• Classe de risco de água (WGK): WGK 3
• Ponto de fulgor (°F): Not applicable
• Ponto de fulgor (°C): Not applicable
• Equipamento de proteção individual: Eyeshields, Gloves, type N95 (US)