ACETONE-D6 #CAS666-52-4
CAS Number:666-52-4
Chemical Formula:C3D6O
Synonyms:
ACETONE-D6, 99.9 ATOM % D (CONTAINS 1% &;ACETONE-D6, "100.0" (MIN. 99.96 ATOM % D)(1pkg=10X1,0ml)
ACETONE-D6 DEUTERATION DEGREE MIN. 99.95
Acetone-d6, packaged in 0.75 ml ampoules, 99.5 atom % D, for NMR
Appearance:Colorless transparent volatile liquid at ambient temperature with characteristic acetone odor; Density:0.88g/cm³@20℃, B.P.55-56℃, F.P.-17℃; Completely miscible with water, ethanol, ether and most organic solvents; Hygroscopic, highly volatile, vapor forms explosive mixture with air.
MOQ (Minimum Order Quantity): 1 FCL (Full Container Load)
ACETONE-D6 #CAS666-52-4
ChEBI: A deuterated compound that is acetone in which all six hydrogen atoms are replaced by deuterium.
Acetone-d6 can be prepared by reacting heavy water with propyne-d4 in the presence of mercury catalyst.
Stable isotope labeled compound, deuterated solvent, special reagent for NMR spectroscopy, isotope tracer for organic synthesis
UN1090, Class3 Highly Flammable Liquid, Packing Group Ⅱ; GHS hazards: H225 Highly flammable liquid and vapor, H319 Causes serious eye irritation, H336 May cause drowsiness or dizziness
HS Code:28459010, Deuterated acetone
Colorless transparent volatile liquid at ambient temperature with characteristic acetone odor; Density:0.88g/cm³@20℃, B.P.55-56℃, F.P.-17℃; Completely miscible with water, ethanol, ether and most organic solvents; Hygroscopic, highly volatile, vapor forms explosive mixture with air.
Application of ACETONE-D6
Isotope labelled Acetone is a common organic building block in organic chemistry
Acetone-d6 may be used as an internal standard to detect aldehydes and acetone in water by headspace-solid-phase microextraction and gas chromatography-mass spectrometry
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.
| ACETONE-D6 Chemical Properties |
| Melting point | −93.8 °C(lit.) |
| Melting point | -94°C |
| Boiling point | 56,5°C |
| Boiling point | 55.5 °C(lit.) |
| density | 0.872 g/mL at 25 °C(lit.) |
| density | d = 0,87 |
| vapor density | 2 (vs air) |
| vapor pressure | 14.39 psi ( 55 °C) |
| refractive index | n |
| Fp | 1 °F |
| storage temp. | Store below +30°C. |
| form | Liquid In Prescored Ampoules, (0.75Ml/ampoule) |
| Specific Gravity | 0.872 |
| color | Colorless |
| PH | 5-6 (365g/l, H2O) |
| explosive limit | 2.6-12.8%(V) |
| Water Solubility | Soluble in water. |
| BRN | 1702935 |
| Stability: | Stable. Highly flammable. Readily forms explosive mixtures with air. Note low flashpoint and wide explosion limits. Incompatible with bases, oxidising agents, strong acids, reducing agents. Protect from moisture. |
| InChI | 1S/C3H6O/c1-3(2)4/h1-2H3/i1D3,2D3 |
| InChIKey | CSCPPACGZOOCGX-WFGJKAKNSA-N |
| SMILES | [2H]C([2H])([2H])C(=O)C([2H])([2H])[2H] |
| CAS DataBase Reference | 666-52-4(CAS DataBase Reference) |
| EPA Substance Registry System | Acetone-d6 (666-52-4) |
| Safety Information |
| Hazard Codes | F,Xi |
| Risk Statements | 11-36-66-67 |
| Safety Statements | 9-16-26-33-23 |
| RIDADR | UN 1090 3/PG 2 |
| WGK Germany | 3 |
| F | 10-21 |
| Autoignition Temperature | 465 °C DIN 51794 |
| HS Code | 2845 90 10 |
| HazardClass | 3 |
| PackingGroup | II |
| Storage Class | 3 - Flammable liquids |
| Hazard Classifications | Eye Irrit. 2 Flam. Liq. 2 STOT SE 3 |
| Toxicity | LD50 orally in Rabbit: 5800 mg/kg LD50 dermal Rabbit 20000 mg/kg |
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