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550574

Sigma-Aldrich

Methanol-OD

99 atom % D

Synonym(s):

mono-Deuteromethanol, Methan(ol-d), Methyl alcohol-OD

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About This Item

Linear Formula:
CH3OD
CAS Number:
Molecular Weight:
33.05
Beilstein:
1730948
EC Number:
MDL number:
UNSPSC Code:
12142201
PubChem Substance ID:
NACRES:
NA.21

isotopic purity

99 atom % D

Quality Level

Assay

≥99.00%

form

liquid

expl. lim.

5.5-36.5 % (lit.)

technique(s)

NMR: suitable

impurities

≤0.0250% water
water

refractive index

n20/D 1.327 (lit.)

bp

65.5 °C (lit.)

mp

-99 °C (lit.)

density

0.813 g/mL at 25 °C (lit.)

mass shift

M+1

SMILES string

[2H]OC

InChI

1S/CH4O/c1-2/h2H,1H3/i2D

InChI key

OKKJLVBELUTLKV-VMNATFBRSA-N

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General description

Methanol-OD is a deuterated form of methanol. It is used as a solvent in NMR-based research and analyses.

Application

Methanol-OD can be used as a deuterated solvent to:
  • Perform APPI HDX MS (atmospheric pressure photoionization hydrogen/deuterium exchange mass spectrometry).
  • Synthesis 1,4-butanediol-D6 (1,4-BD-D6)from 1,4-butanediol-D8.

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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

Storage Class Code

3 - Flammable liquids

WGK

WGK 2

Flash Point(F)

51.8 °F - closed cup

Flash Point(C)

11.0 °C - closed cup


Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

EU REACH Annex XVII (Restriction List)

CAS No.

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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High Resolution Fourier Transform Far Infrared Spectroscopy of CH3OD.
Mukhopadhyay I, et al.
Journal of Molecular Spectroscopy, 186(1), 15-21 (1997)
Dehydration of alcohols over alumina. VIII. Ether formation from the deuterated methanols CH3OH, CD3OH, CH3OD, and CD3OD.
Knozinger H, et al.
The Journal of Physical Chemistry, 72(8), 2770-2774 (1968)
The Raman Spectra of the Methyl Alcohols, CH3OH, CH3OD, and CH2DOD.
Halford JO, et al.
J. Chem. Phys. , 5(12), 927-932 (1937)
Photoionization of CH3OH, CD3OH, and CH3OD: Dissociative ionization mechanisms and ionic structures.
Berkowitz J.
J. Chem. Phys., 69(7), 3044-3054 (1978)
Deuterium isotope effect on the solvation dynamics of methanol: CH3OH, CH3OD, CD3OH, and CD3OD.
Shirota H, et al.
The Journal of Physical Chemistry, 100.(35), 14575-14577 (1996)

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