Deuterated ethanol

Deuterated ethanol
Names
Preferred IUPAC name
(2H5)Ethan(2H)ol
Other names
  • Ethanol-d6
  • Ethyl alcohol-d6
  • Ethyl-d5 alcohol-d
  • Hexadeuteroethanol
Identifiers
CAS Number
  • 1516-08-1
3D model (JSmol)
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ChemSpider
  • 92272
ECHA InfoCard 100.014.693 Edit this at Wikidata
PubChem CID
  • 102138
CompTox Dashboard (EPA)
  • DTXSID80934298 Edit this at Wikidata
InChI
  • Key: LFQSCWFLJHTTHZ-LIDOUZCJSA-N
  • InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3/i1D3,2D2,3D
  • [2H]C([2H])([2H])C([2H])([2H])O[2H]
Properties
Chemical formula
C2D6O
Molar mass 52.10 g/mol
Density 0.892 g/mL[1]
Boiling point 78 °C (172 °F; 351 K)[1]
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
Infobox references
Chemical compound

Deuterated ethanol (C2D5OD)[2] is a form (called an isotopologue) of ethanol (C2H5OH) in which the hydrogen atom ("H") is replaced with deuterium (heavy hydrogen) isotope ("D"). Deuterated ethanol is an uncommon solvent used in NMR spectroscopy.

References

  1. ^ a b "Ethanol-d6". Sigma-Aldrich.
  2. ^ March, Raymond E.; Todd, John F. J. (2010). Practical Aspects of Trapped Ion Mass Spectrometry: Applications of Ion Trapping Devices. CRC Press. p. 38. ISBN 978-1-4200-8373-6.
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Reference
1H and 13C chemical shifts


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