57117-36-9

Usage

Uses

Used in Environmental Testing and Research:
1,3,6,7-Tetrachlorodibenzofuran is used as a standard in environmental testing and research for various applications, including the fingerprinting of pesticides. It plays a crucial role in understanding the formation of dioxins during the decomposition of these pesticides and their reactions under UV light. This information is vital for assessing the environmental impact and potential health risks associated with pesticide use and dioxin exposure.

InChI:InChI=1/C12H4Cl4O/c13-5-3-8(15)10-6-1-2-7(14)11(16)12(6)17-9(10)4-5/h1-4H

Upstream product

• 83704-36-3 1,3,4,6,7-pentachlorodibenzofuran 
• 57117-42-7 1,2,3,6,7-pentachlorodibenzofuran 
• 56558-17-9 2,3',4,4'6-pentachlorobiphenyl 
• 32598-10-0 2,3',4,4'-terachlorobiphenyl 
• 39485-83-1 2,2',4,4',6-pentachlorobiphenyl 

Relevant academic research and scientific papers

Isomer distributions of polychlorinated dibenzo-p-dioxins/dibenzofurans formed during de novo synthesis on incinerator fly ash

Polychlorinated dibenzo-p-dioxins (PCDD) and dibenzofurans (PCDF) emitted from municipal waste incinerators appear to have a chlorination pattern that is quite constant across various samples and conditions. This suggested that these patterns may be controlled by thermodynamic properties of the individual PCDD/F congeners, such as the free Gibbs energy of formation (Δg°(f,T)). This would make prediction of the isomer composition of a particular sample (and hence its TEQ value) possible, based on values of ΔG°(f,T). A laboratory scale study was carried out with activated carbon on fly ash as the source of PCDD/F formation. Although it was found that the isomer distributions within homologues were independent of the reaction time (proof of thermodynamic control), other observations (lack of equilibrium/isomerization between isomers and lack of similarity between isomer distributions measured and predicted by ΔG°(f,T)) contradicted the possibility of thermodynamic control. Hence, this study could not confirm that de novo formation of PCDD/F could explain thermodynamically controlled isomer distributions in incinerators. Some recommendations for further work- time-based studies with precursors, isomerization studies with single congeners, and more data on ΔG°(f,T) values of PCDD/F-were made. Polychlorinated dibenzo-p-dioxins (PCDD) and dibenzofurans (PCDF) emitted from municipal waste incinerators appear to have a chlorination pattern that is quite constant across various samples and conditions. This suggested that these patterns may be controlled by thermodynamic properties of the individual PCDD/F congeners, such as the free Gibbs energy of formation (ΔG°f,T). This would make prediction of the isomer composition of a particular sample (and hence its TEQ value) possible, based on values of ΔG°f,T. A laboratory scale study was carried out with activated carbon on fly ash as the source of PCDD/F formation. Although it was found that the isomer distributions within homologues were independent of the reaction time (proof of thermodynamic control), other observations (lack of equilibrium/isomerization between isomers and lack of similarity between isomer distributions measured and predicted by ΔG°f,T) contradicted the possibility of thermodynamic control. Hence, this study could not confirm that de novo formation of PCDD/F could explain thermodynamically controlled isomer distributions in incinerators. Some recommendations for further work - time-based studies with precursors, isomerization studies with single congeners, and more data on ΔG°f,T values of PCDD/F - were made.

Synthesis of the 38 Tetrachlorodibenzofuran Isomers and Identification by Capillary Column Gas Chromatography/Mass Spectrometry

The 38 positional isomers of tetrachlorodibenzofuran have been synthesized by pyrolysis of specific polychlorinated biphenyl congeners, ultraviolet photolysis of pentachlorodibenzofurans, and chlorination of trichlorodibenzofurans by aromatic substitution.The specificity of these reactions in combinatiuon with capillary column gas chromatography with mass spectrometric detection has allowed each of these isomers to be identified based on their relative elution order.