Acetone-d6, 99.9 atom % D

Code: 151793-50g D2-231

Application

Acetone-d6 may be used as a deuterated solvent in the 1H NMR spectral studies of iodine containing radiopaque poly(methacrylate)copolymers. ...


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Application

Acetone-d6 may be used as a deuterated solvent in the 1H NMR spectral studies of iodine containing radiopaque poly(methacrylate)copolymers. It may also be used as a source of deuterium atoms in the synthesis of labelled sterols.

General description

Acetone-d6 (CD3COCD3, Hexadeuteroacetone) is the hexadeuterated form of acetone, in which all hydrogen atoms in acetone molecule have been replaced by deuterium (D) atoms. It is a standard purity solvent for NMR (Nuclear Magnetic Resonance) analyses. Absorption spectra of CD3COCD3 samples cooled in molecular jet (jet-cooled) have been evaluated in the range of 51000-54000cm-1. Collision of its molecular ions with a perdeuterated surface (C20D41 SAu) was investigated by ion-surface collision spectroscopy. The Infrared and Raman spectra of acetone-d6 have been analyzed. It undergoes H-2H exchange reaction with acetone d0 to afford acetone d1 and d5.

Legal Information

Sure/Seal is a trademark of Sigma-Aldrich Co. LLC

Packaging

10×0.75, 10×1 mL in ampule

100 g in Sure/Seal™

25, 50 g in glass bottle

10 g in ampule

assay≥99% (CP)
bp55.5 °C (lit.)
density0.872 g/mL at 25 °C (lit.)
expl. lim.13.2 %
formliquid
impurities≤0.0500% waterwater
InChI keyCSCPPACGZOOCGX-WFGJKAKNSA-N
InChI1S/C3H6O/c1-3(2)4/h1-2H3/i1D3,2D3
isotopic purity99.9 atom % D
mass shiftM+6
mp−93.8 °C (lit.)
packagingSure/Seal™ of 100 g, glass bottle of 25 g, 50 g, ampule of 0.75 mL, 1 mL, 10 g
Quality Level200
refractive indexn20/D 1.355 (lit.)
SMILES string[2H]C([2H])([2H])C(=O)C([2H])([2H])[2H]
technique(s)NMR: suitable
vapor density2 (vs air)
vapor pressure3.67 psi ( 20 °C), 184 mmHg ( 20 °C), 14.39 psi ( 55 °C)
Cas Number666-52-4
Hazard Class3
Un Number1090
Pack GroupII
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