50671-05-1

Basic information

• Product Name: 3-(2-BROMO-PHENYL)-3-OXO-PROPIONIC ACID ETHYL ESTER
• Synonyms: 3-(2-BROMO-PHENYL)-3-OXO-PROPIONIC ACID ETHYL ESTER;ETHYL 3-(2-BROMOPHENYL)-3-OXOPROPANOATE;ETHYL (2-BROMOBENZOYL)ACETATE
• CAS NO: 50671-05-1
• Molecular Formula: C₁₁H₁₁BrO₃
• Molecular Weight: 271.11
• Product Categories: C10 to C11;Carbonyl Compounds;Esters;Building Blocks;C10 to C11;Carbonyl Compounds;Chemical Synthesis;Organic Building Blocks
• Mol File: 50671-05-1.mol

Chemical Properties

• Boiling Point: 323.8°C at 760 mmHg
• Flash Point: >230 °F
• Appearance: /
• Density: 1.417 g/mL at 25 °C(lit.)
• Vapor Pressure: 0.000256mmHg at 25°C
• Refractive Index: n20/D 1.5545(lit.)
• Storage Temp.: Sealed in dry,Room Temperature
• CAS DataBase Reference: 3-(2-BROMO-PHENYL)-3-OXO-PROPIONIC ACID ETHYL ESTER(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(2-BROMO-PHENYL)-3-OXO-PROPIONIC ACID ETHYL ESTER(50671-05-1)
• EPA Substance Registry System: 3-(2-BROMO-PHENYL)-3-OXO-PROPIONIC ACID ETHYL ESTER(50671-05-1)

Safety Data

• WGK Germany: 3
• Hazardous Substances Data: 50671-05-1(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
3-(2-BROMO-PHENYL)-3-OXO-PROPIONIC ACID ETHYL ESTER is used as a reactant for the preparation of various pharmaceutical compounds, such as:
1. Cambinol analogs: These analogs act as sirtuin inhibitors with antitumor action, making them valuable in the development of cancer treatments. The bromine atom in the molecule allows for further functionalization and modification to optimize the biological activity of the resulting compounds.
2. Quinolones and indoles: These are important classes of antibiotics and anti-cancer agents, respectively. The ethyl ester group in the molecule can be used to facilitate the cyclodehydration reaction, leading to the formation of these biologically active compounds.
3. N-allyl/propargyl enamine carboxylates: These are useful intermediates in organic synthesis, particularly for the preparation of complex organic molecules with potential applications in the pharmaceutical industry. The bromine atom in the molecule can be used to introduce allyl or propargyl groups, which can then be further modified to obtain the desired enamine carboxylates.

InChI:InChI=1/C11H11BrO3/c1-2-15-11(14)7-10(13)8-5-3-4-6-9(8)12/h3-6H,2,7H2,1H3

Upstream product

• 119031-20-8 2-(2-bromo-benzoyl)-3-oxo-butyric acid ethyl ester 
• 623-73-4 diazoacetic acid ethyl ester 
• 6630-33-7 ortho-bromobenzaldehyde 
• 6148-64-7 ethyl potassium malonate 
• 90766-96-4 N-(2-bromobenzoyl)imidazole 
• 7154-66-7 2-bromobenzoic acid chloride 
• 6091-64-1 2-bromobenzoic acid ethyl ester 
• 141-78-6 ethyl acetate 
• 610-94-6 2-bromobenzoic acid methyl ester 
• 88-65-3 2-bromobenzoic-acid 

Downstream Products

• 50670-86-5 α-Chlor-α-(2-brombenzoyl)-5-<α-(2,4-di-t-amylphenoxy)-acetylamino>-2-chloracetanilid 
• 1332622-30-6 ethyl 3-(2-bromophenyl)-2-[(4-phenylbutyl-2-amino)methylene]-3-oxopropanoate 
• 1332622-31-7 ethyl 3-(2-bromophenyl)-2-[(4-pyridinmethylamino)methylene]-3-oxopropanoate 
• 1332622-34-0 ethyl 4-oxo-1-(1-methyl-3-phenylpropyl)-1,4-dihydroquinoline-3-carboxylate 
• 1332622-38-4 4-oxo-1-(1-methyl-3-phenylpropyl)-1,4-dihydroquinoline-3-carboxylic acid 
• 1332622-47-5 4-oxo-1-(1-methyl-3-phenylpropyl)-N-(1-phenylethyl)-1,4-dihydroquinoline-3-carboxamide 
• 1332622-48-6 4-oxo-1-(1-methyl-3-phenylpropyl)-N-(2-methylphenyl)-1,4-dihydroquinoline-3-carboxamide 
• 311340-72-4 ethyl 3-(2-bromophenyl)-2-[(dimethylamino)methylene]-3-oxopropanoate 
• 135774-34-4 o-bromo-α-fluoroacetophenone 
• 1450828-30-4 3-(2-bromophenyl)-3-aminoacrylic acid ethyl ester 
• 62123-82-4 ethyl 2-(2-bromophenyl)-2-oxoacetate 

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