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708941 Sigma-Aldrich

Acetone-d6

NMR reference standard, 99.96 atom % D, NMR tube size 5 mm × 7 in.

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 329762838

  •  NACRES NA.12

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Properties

Related Categories NMR Reference Standards, NMR Solvents and Reagents, Stable Isotopes More...
Quality Level   200
grade   NMR reference standard
vapor density   2 (vs air)
vapor pressure   14.39 psi ( 55 °C)
  184 mmHg ( 20 °C)
  3.67 psi ( 20 °C)
isotopic purity   99.96 atom % D
expl. lim.   13.2 %
packaging   tube of 0.700 mL (5 mm O.D.)
NMR tube size   5 mm × 7 in.
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
SMILES string   [2H]C([2H])([2H])C(=O)C([2H])([2H])[2H]
InChI   1S/C3H6O/c1-3(2)4/h1-2H3/i1D3,2D3
InChI key   CSCPPACGZOOCGX-WFGJKAKNSA-N

Description

Quantity

5 mm O.D. tube contains 0.700 mL.

Safety & Documentation

Safety Information

Symbol 
Signal word 
Danger
Hazard statements 
Precautionary statements 
RIDADR 
UN1090 - class 3 - PG 2 - Acetone
WGK Germany 
WGK 3
Flash Point(F) 
-2.2 °F - closed cup
Flash Point(C) 
-19 °C - closed cup

Documents

Certificate of Analysis (COA)

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