Acetone-D6 99.9 atom % D, 25 grams

Acetone-D6 99.9 atom % D, 25 grams

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Acetone-D6 99.9 Atom% D 25 Gram

Synonym: Hexadeuteroacetone

  • CAS Number 666-52-4
  • Linear Formula CD3COCD3
  • Molecular Weight 64.12
  • Beilstein/REAXYS Number 1702935
  • EC Number 211-563-9
  • MDL number MFCD00044635
  • PubChem Substance ID 24848854

vapor density 2 (vs air)
vapor pressure 14.39 psi ( 55 °C)
184 mmHg ( 20 °C)
3.67 psi ( 20 °C)
isotopic purity 99.9 atom % D
assay ≥99% (CP)
expl. lim. 13.2 %

Sure/Seal™ of 100 g
ampule of 0.75 mL, 1 mL, 10 g
glass bottle of 25 g, 50 g

impurities ≤0.0500% water
refractive index n20/D 1.355 (lit.)
bp 55.5 °C(lit.)
mp −93.8 °C (lit.)
density 0.872 g/mL at 25 °C (lit.)
mass shift M+6

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Hexadeuteroacetone) is the hexadeuterated form of acetone, in which all hydrogen atoms in acetone molecule have been replaced by deuterium (D) atoms.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.


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.

Safety Information


Signal word Danger
Hazard statements H225-H319-H336
Precautionary statements P210-P261-P305 + P351 + P338
Supplemental Hazard Statements Repeated exposure may cause skin dryness or cracking.
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US)
RIDADR UN1090 - class 3 - PG 2 - Acetone
WGK Germany 3
Flash Point(F) -2.2 °F
Flash Point(C) -19 °C


Safety Data Sheet


Note: These chemicals are for research & laboratory use only. Your order will not be processed if you do not work for, and ship to, a registered laboratory or research facility. Not for topical applications. An official Declaration of Use form may be required.

Most chemicals cannot be expedited.

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WARNING: This product can expose you to chemicals which are known to the State of California to cause cancer and reproductive harm. Prop 65 Warning

Please note: This product is not returnable.

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