130745-77-6

Basic information

• Product Name: 3,3-BIS(4-CHLOROBENZYL)-2,4-PENTANEDIONE
• Synonyms: 3,3-BIS(4-CHLOROBENZYL)-2,4-PENTANEDIONE;3,3-Bis(4-chlorobenzyl)pentane-2,4-dione
• CAS NO: 130745-77-6
• Molecular Formula: C₁₉H₁₈Cl₂O₂
• Molecular Weight: 349.25
• Mol File: 130745-77-6.mol
• Article Data: 1

Chemical Properties

• Melting Point: 109-111°C
• Boiling Point: 441.3°Cat760mmHg
• Flash Point: 186.1°C
• Appearance: /
• Density: 1.231g/cm³
• Vapor Pressure: 5.49E-08mmHg at 25°C
• Refractive Index: 1.571
• CAS DataBase Reference: 3,3-BIS(4-CHLOROBENZYL)-2,4-PENTANEDIONE(CAS DataBase Reference)
• NIST Chemistry Reference: 3,3-BIS(4-CHLOROBENZYL)-2,4-PENTANEDIONE(130745-77-6)
• EPA Substance Registry System: 3,3-BIS(4-CHLOROBENZYL)-2,4-PENTANEDIONE(130745-77-6)

Safety Data

• Hazard Codes: Xi
• HazardClass: IRRITANT
• Hazardous Substances Data: 130745-77-6(Hazardous Substances Data)

Usage

General Description

3,3-BIS(4-CHLOROBENZYL)-2,4-PENTANEDIONE is a chemical compound with the molecular formula C21H20Cl2O2. It is a diketone compound that is commonly used as a chelating agent in metal extraction and separation processes. 3,3-BIS(4-CHLOROBENZYL)-2,4-PENTANEDIONE is known for its ability to form stable complexes with a wide range of metal ions, making it a valuable tool in industries such as mining and metallurgy. Additionally, 3,3-BIS(4-CHLOROBENZYL)-2,4-PENTANEDIONE has been studied for its potential pharmacological properties, including its antimicrobial and antitumor activities. However, further research is needed to fully understand the potential applications of this compound.

InChI:InChI=1/C19H18Cl2O2/c1-13(22)19(14(2)23,11-15-3-7-17(20)8-4-15)12-16-5-9-18(21)10-6-16/h3-10H,11-12H2,1-2H3

Upstream product

• 622-95-7 4-chlorobenzyl bromide 
• 123-54-6 acetylacetone 

Relevant articles and documents

C-ALKYLATION OF β-DIKETONES WITH BENZYLPYRIDINIUM SALTS. EVIDENCE FOR CHAIN RADICAL MECHANISMS

1-(p-Substituted benzyl)-2,4,6-triphenylpyridinium cations react with β-diketone anions by mechanisms which depend on the para-substituent.The p-methoxybenzyl derivative undergoes SN1 displacement yielding O- and C-benzylated products.The p-nitrobenzyl compound reacts by a chain radicaloid mechanism and gives high yields of C-p-nitrobenzylated diketones.The parent benzyl compound forms some C- and some O-benzylated products, together with bibenzyl, probably by a radical chain reaction which was suppressed by radical traps.