EMAIL THIS PAGE TO A FRIEND
186414 Sigma-Aldrich

Ethanol-d6

anhydrous, ≥99.5 atom % D

Synonym: Ethyl alcohol-d6, Ethyl-d5 alcohol-d, Hexadeuteroethanol

  • CAS Number 1516-08-1

  • Linear Formula CD3CD2OD

  • Molecular Weight 52.11

  •  Beilstein/REAXYS Number 1699096

  •  EC Number 216-162-2

  •  MDL number MFCD00051020

  •  PubChem Substance ID 24851220

  •  NACRES NA.21

Purchase

Properties

Related Categories Additional NMR Solvents, Alphabetical Listings, Common NMR Solvents, E-F, NMR Solvents,
Quality Level   200
grade   anhydrous
isotopic purity   ≥99.5 atom % D
assay   ≥99% (CP)
form   liquid
expl. lim.   3.5-15 % (lit.)
application(s)   NMR: suitable
refractive index   n20/D 1.358 (lit.)
bp   78 °C (lit.)
mp   -130 °C (lit.)
density   0.892 g/mL at 25 °C
mass shift   M+6
SMILES string   [2H]OC([2H])([2H])C([2H])([2H])[2H]
InChI   1S/C2H6O/c1-2-3/h3H,2H2,1H3/i1D3,2D2,3D
InChI key   LFQSCWFLJHTTHZ-LIDOUZCJSA-N

Description

General description

Ethanol-d6 is a deuterated derivative of ethanol. It has an isotopic purity of 99.5atom%D. It is a standard purity solvent suitable for routine NMR analyses (conducted at ambient temperatures where quality is less critical).

Application

Ethanol-d6 may be used as a solvent for the tributylphosphine (PBu3) induced 5-exo cyclization of an o-alkynoylphenol to form deuterated aurone.

Packaging

1, 5 g in ampule

Safety & Documentation

Safety Information

Symbol 
GHS02  GHS02
Signal word 
Danger
Hazard statements 
Precautionary statements 
RIDADR 
UN1170 - class 3 - PG 2 - Ethanol
WGK Germany 
WGK 3
Flash Point(F) 
57.2 °F - closed cup
Flash Point(C) 
14 °C - closed cup
Protocols & Articles

Articles

GC/MS Analysis of Ethanol in Low Alcohol Beer on SUPELCOWAX® 10 after Headspace SPME using a 100 μm PDMS Fiber

From our library of Articles, Sigma-Aldrich presents GC/MS Analysis of Ethanol in Low Alcohol Beer on SUPELCOWAX® 10 after Headspace SPME using a 100 μm PDMS Fiber
Keywords: Chromatography, Gas chromatography, Mass spectrometry, Sample preparations, Solid phase microextractions

NMR Deuterated Solvent Properties Reference Chart

Use the chart below to look up the coupling values — JHD and JCD(JCF) distance between multiplet peaks in hertz (Hz) — and chemical shift delta values — ðH(Mult)b and ðc(Mult)b in parts per million (...
Keywords: Melting, Nuclear magnetic resonance spectroscopy, Solvents

Pressure-Temperature Calculator for Solvents

*Calculations provide estimated results based on Antoine's Coefficients and their associated temperature range values. Antoine's Coefficients were obtained from the National Institute of Standards an...

Peer-Reviewed Papers
15

References

Related Products

Technical Service:

Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.

Bulk Ordering & Pricing:

Need larger quantities for your development, manufacturing or research applications?