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Sigma-Aldrich

Ethanol-d6

anhydrous, ≥99.5 atom % D

Synonym(s):

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

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About This Item

Linear Formula:
CD3CD2OD
CAS Number:
Molecular Weight:
52.11
Beilstein/REAXYS Number:
1699096
EC Number:
MDL number:
UNSPSC Code:
12142201
PubChem Substance ID:
NACRES:
NA.21

grade

anhydrous

Quality Level

isotopic purity

≥99.5 atom % D

assay

≥99% (CP)

form

liquid

expl. lim.

3.5-15 % (lit.)

technique(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

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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.

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pictograms

FlameExclamation mark

signalword

Danger

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 2

Storage Class

3 - Flammable liquids

wgk_germany

WGK 1

flash_point_f

55.4 °F

flash_point_c

13 °C


Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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An Efficient Synthesis of Aurone Derivatives by the Tributylphosphine-catalyzed Regioselective Cyclization of o-Alkynoylphenols.
Saito K, et al.
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Articles

Use this reference table to find the coupling values and chemical shifts of our NMR (deuterated) solvents. Melting and boiling points, molecular weight, density, and CAS number are also listed.

Protocols

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

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