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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:
1516-08-1
Molecular Weight:
52.11
Beilstein/REAXYS Number:
1699096
EC Number:
216-162-2
MDL number:
MFCD00051020
UNSPSC Code:
12142201
PubChem Substance ID:
24851220
NACRES:
NA.21

grade

anhydrous

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
GHS02,GHS07

signalword

Danger

hcodes

H225,H319

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 2

Storage Class

3 - Flammable liquids

wgk_germany

WGK 1

flash_point_f

55.4 °F - closed cup

flash_point_c

13 °C - closed cup

Certificates of Analysis (COA)

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An Efficient Synthesis of Aurone Derivatives by the Tributylphosphine-catalyzed Regioselective Cyclization of o-Alkynoylphenols.
Saito K, et al.
Chemistry Letters (Jpn), 44(2), 141-143 (2015)

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