1,3-Propane-d6-dithiol

Product Name 1,3-Propane-d6-dithiol
CAT No. CS-C-00503
CAS No. 1219803-51-6
Category Stable Isotopes
Stock Enquire
Mol. Wt. 114.26 g/mol
Mol. For. C3H2D6S2
Hazardous This is not a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Industry Flavours and Fragrances
Canonical Smiles C(CS)CS
InchIKey ZJLMKPKYJBQJNH-NMFSSPJFSA-N
Inchl InChI=1S/C3H8S2/c4-2-1-3-5/h4-5H,1-3H2/i1D2,2D2,3D2
IUPAC 1,1,2,2,3,3-hexadeuteriopropane-1,3-dithiol
Controlled No
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1,3-Propane-d6-dithiol is a deuterated derivative of 1,3-propanedithiol, a colorless liquid with a strong and unpleasant odor. The compound is used as a reagent in organic synthesis, as a cross-linking agent in polymer chemistry, and as a ligand in coordination chemistry. The deuterium substitution at the 6-position of the molecule is useful for NMR spectroscopy studies, as it enhances the resolution of the spectra and allows for more accurate measurements. In terms of chemical information, 1,3-Propane-d6-dithiol has a molecular formula of C3D6S2 and a molecular weight of 112.26 g/mol. It has a boiling point of 147-148 °C and a melting point of -9 °C. The compound is soluble in water, ethanol, and diethyl ether, and reacts with strong oxidizing agents. The compound is also known to exhibit strong nucleophilic behavior due to the presence of the thiol groups, which can form covalent bonds with electrophiles. This makes it a valuable reagent in organic synthesis, as it can be used to introduce sulfur-containing functional groups into molecules. In summary, 1,3-Propane-d6-dithiol is a useful compound in both organic and inorganic chemistry due to its reactivity and deuterium substitution. Its chemical properties make it a valuable tool for NMR spectroscopy studies, and its ability to act as a nucleophile adds to its versatility in organic synthesis.

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