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Bis(2-Chloroethoxy)methane-[d8]

General Information
Catalog: BLP-011494
CAS: 93966-78-0
Molecular Formula: C5H2D8Cl2O2
Molecular Weight: 181.09
Chemical Structure
Bis(2-Chloroethoxy)methane-[d8]
Description Bis(2-Chloroethoxy)methane-[d8] is the labelled analogue of Bis(2-Chloroethoxy)methane, which is a chloroether used to manufacture polysulfide polymers.
Synonyms bis(2-Chloroethoxy)-d8-methane; Bis(2-chloroethyl)Formal-d8; Bis(β-chloroethyl)Formal-d8; 1,7-Dichloro-3,5-dioxaheptane-d8; Di(2-chloroethoxy)methane-d8; Di-2-chloroethyl Formal-d8; Formaldehyde Bis(2-chloroethyl)Acetal-d8; Formaldehyde Bis(β-chloroethyl)Acetal-d8; NSC 5212-d8
IUPAC Name 1-chloro-2-[(2-chloro-1,1,2,2-tetradeuterioethoxy)methoxy]-1,1,2,2-tetradeuterioethane
Related CAS 111-91-1 (unlabelled)
Canonical SMILES C(CCl)OCOCCCl
InChI InChI=1S/C5H10Cl2O2/c6-1-3-8-5-9-4-2-7/h1-5H2/i1D2,2D2,3D2,4D2
InChI Key NLXGURFLBLRZRO-SVYQBANQSA-N
Boiling Point -33°C
Melting Point 218.1°C
Purity 98%; 98% atom D
Density 1.2339 g/mL at 20°C
Solubility Soluble in Water (Slightly), Chloroform (Sparingly), Methanol (Slightly)
Appearance Liquid
Storage Store at 2-8°C under inert atmosphere

Bis(2-Chloroethoxy)methane-[d8], a deuterated chemical compound, finds extensive use in research and industrial settings. Here are key applications of Bis(2-Chloroethoxy)methane-[d8] presented with high perplexity and burstiness:

Nuclear Magnetic Resonance (NMR) Spectroscopy: The deuterated variant of Bis(2-Chloroethoxy)methane proves invaluable in NMR spectroscopy investigations. Its incorporation in experiments enables the observation of chemical behaviors of compounds sans interference from hydrogen atoms in solvents, enhancing spectral clarity and resolution. This heightened precision aids researchers in meticulously dissecting molecular structures.

Isotope-Labeling Experiments: Bis(2-Chloroethoxy)methane-[d8] plays a pivotal role in isotope labeling for diverse biochemical and pharmaceutical studies. Deuterium atoms offer key insights into reaction mechanisms and kinetic isotope effects, shedding light on intricate molecular interactions. This knowledge is paramount in the formulation of novel drugs and unraveling complex biochemical pathways.

Chemical Synthesis: Within synthetic chemistry realms, Bis(2-Chloroethoxy)methane-[d8] serves as a versatile building block or reagent. Its utility extends to the synthesis of intricate organic molecules, especially in cases requiring isotope labeling for tracing purposes. This broadens its application scope in crafting compounds for cutting-edge research endeavors and specialized industrial procedures.

Environmental Tracing: Beyond laboratory settings, this compound can be utilized in environmental sciences for tracing purposes in ecological studies. By utilizing deuterated compounds as tracers in environmental samples, scientists can monitor substance movement and degradation in ecosystems. This data is vital for comprehending environmental dynamics and evaluating the implications of chemical pollutants.

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