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Key Documents

151947

Sigma-Aldrich

Methanol-d4

≥99.8 atom % D

Synonym(s):

Methyl-d3 alcohol d, Tetradeuteromethanol

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About This Item

Linear Formula:
CD3OD
CAS Number:
Molecular Weight:
36.07
Beilstein:
1733278
EC Number:
MDL number:
UNSPSC Code:
12352104
PubChem Substance ID:
NACRES:
NA.21

isotopic purity

≥99.8 atom % D

Quality Level

Assay

≥99% (CP)

form

liquid

expl. lim.

5.5-36.5 % (lit.)

technique(s)

HPLC: suitable
NMR: suitable

impurities

≤0.025% water

refractive index

n20/D 1.326 (lit.)

bp

65.4 °C (lit.)

mp

-99 °C (lit.)

density

0.888 g/mL at 25 °C (lit.)

format

neat

SMILES string

[2H]OC([2H])([2H])[2H]

InChI

1S/CH4O/c1-2/h2H,1H3/i1D3,2D

InChI key

OKKJLVBELUTLKV-MZCSYVLQSA-N

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Application

Methanol-d4 may have been used as solvent in the nuclear magnetic resonance spectrum analysis for:
  • characterizing phenolic compounds separated from olive oil using high performance liquid chromatography.
  • vanillic acid and 4-hydroxy-3-methoxystyrene formed via biotransformation of Rhodotorula rubra.

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Signal Word

Danger

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Flam. Liq. 2 - STOT SE 1

Target Organs

Eyes,Central nervous system

Storage Class Code

3 - Flammable liquids

WGK

WGK 2

Flash Point(F)

49.5 °F - closed cup

Flash Point(C)

9.7 °C - closed cup


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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.

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NMR spectroscopy elucidates molecular structure and purity via nuclear spin states in a strong magnetic field.

Global Trade Item Number

SKUGTIN
151947-10G-AMP4061838739988
151947-10X10G
151947-10X50G-N4061837649158
151947-1G4061838739995
151947-100G4061838739971
151947-10G
151947-10G-GL4061837649134
151947-10G-SB4061837649141
151947-10X0.3ML-N4061837613265
151947-1KG4061838252135
151947-25G4061838740007
151947-50G
151947-50G-GL4061837649165
151947-50G-SB4061838740014
151947-5G4061838740021

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