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Endosulfan-I-[d4]

General Information
Catalog: BLP-005304
CAS: 203645-57-2
Molecular Formula: C11H8D4Cl6O3S
Molecular Weight: 441.2
Chemical Structure
Endosulfan-I-[d4]
Description Endosulfan-[d4] is the labelled analogue of Endosulfan, which is a broad-spectrum organochlorine insecticide that is used in the control and protection of plant and vegetation.
Synonyms Endosulfan-I-1,1,5,5 D4; 6,7,8,9,10,10-hexachloro-1,5,5a,6,9,9a-hexahydro-6,9-methanobenzo[e][1,3,2]dioxathiepine 3-oxide-1,1,5,5-d4
IUPAC Name (1S,2R,8S,9R)-1,9,10,11,12,12-hexachloro-3,3,7,7-tetradeuterio-4,6-dioxa-5λ4-thiatricyclo[7.2.1.02,8]dodec-10-ene 5-oxide
Related CAS 959-98-8 (unlabelled)
Canonical SMILES C1C2C(COS(=O)O1)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl
InChI InChI=1S/C9H6Cl6O3S/c10-5-6(11)8(13)4-2-18-19(16)17-1-3(4)7(5,12)9(8,14)15/h3-4H,1-2H2/t3-,4+,7-,8+,19?/i1D2,2D2
InChI Key RDYMFSUJUZBWLH-WWUWEAHGSA-N
Purity 97 atom % D
Solubility Soluble in Dichloromethane
Appearance Maroon Solid
Storage Store at -20°C, Under inert atmosphere

Endosulfan-I-[d4], a deuterated analogue of the pesticide endosulfan, holds diverse applications in various research fields, particularly in environmental and analytical chemistry. Here are key applications of Endosulfan-I-[d4] presented with a high degree of perplexity and burstiness:

Environmental Monitoring: Employing Endosulfan-I-[d4] as an internal standard, researchers engage in comprehensive environmental studies to monitor the presence and concentration of endosulfan contaminants. By integrating this stable isotope-labeled compound, scientists can meticulously quantify endosulfan levels in diverse mediums, such as soil, water, and biological samples. This detailed assessment is pivotal for evaluating pollution levels and comprehending the hazardous implications of pesticide exposure on the environment.

Analytical Chemistry: In the realm of analytical chemistry, Endosulfan-I-[d4] serves as a reference material for calibrating analytical instruments like gas chromatography-mass spectrometry (GC-MS). Its usage as an internal standard facilitates the precise measurement of endosulfan residues in complex matrices. This calibration significantly enhances the reliability and accuracy of analytical techniques used in pesticide residue analysis, ensuring robust and dependable results.

Research on Metabolic Pathways: Leveraging Endosulfan-I-[d4], researchers delve deep into the intricate metabolic pathways and degradation processes of endosulfan within environmental and biological systems. The inclusion of a deuterium label enables the tracking of chemical transformations and the identification of metabolites. This essential data aids in understanding the fate of endosulfan in the environment and its biological impacts, shedding light on the complex interplay between chemicals and living organisms.

Toxicological Studies: In the field of toxicology, Endosulfan-I-[d4] plays a pivotal role in exploring the toxicokinetics and dynamics of endosulfan exposure. Researchers utilize this compound to investigate the absorption, distribution, metabolism, and excretion (ADME) of endosulfan within living organisms. These studies are crucial for evaluating potential health risks, establishing safety standards for pesticide usage, and safeguarding the well-being of both humans and the environment.

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