| Identification | More | [Name]
ACETONITRILE-D3 | [CAS]
2206-26-0 | [Synonyms]
ACETONITRILE-D3
DEUTERATED ACETONITRILE
METHYLCYANIDE DEUTERATED
TRIDEUTEROACETONITRILE
CD3CN
Methyl-d3 cyanide
Perdeuterioacetonitrile
Perdeuteroacetonitrile
Trideuterioacetonitrile
Acetonitrile-d3
Acetonitrile-d3
Acetonitriledisotopicpurity
[2H3]acetonitrile
ACETONITRILE-D3, 99.8 ATOM % D (CONTAINS
ACETONITRILE-D3,99.8 ATOM % D (CONTAINSAP PROXIMATELY 15-20% D2O)
ACETONITRILE-D3 + 0.05% TMS (V/V) 99.8%
ACETONITRILE-D3, 99.8 ATOM % D (CONTAINS 0.03% V/V TMS)
ACETONITRILE-D3, 99.8 ATOM % D (1 PKG =10 X 1ML)
ACETONITRILE-D3, 99.8 ATOM % D (1PKG = 5 X 0.5ML)
ACETONITRILE-D3 99.6 ATOM % D | [EINECS(EC#)]
218-616-5 | [Molecular Formula]
C2D3N | [MDL Number]
MFCD00001881 | [Molecular Weight]
44.07 | [MOL File]
2206-26-0.mol |
| Chemical Properties | Back Directory | [Appearance]
colourless liquid | [Melting point ]
-46 °C
| [Boiling point ]
80.7 °C(lit.)
| [density ]
0.844 g/mL at 25 °C(lit.)
| [vapor pressure ]
97 hPa (20 °C) | [refractive index ]
n20/D 1.341(lit.)
| [Fp ]
42 °F
| [storage temp. ]
Flammables area | [form ]
Liquid In Prescored Ampoules, (0.75Ml/ampoule) | [color ]
Colorless | [Specific Gravity]
0.844 | [Stability:]
Stable. Flammable. Incompatible with strong oxidizing agents, strong acids. | [explosive limit]
3.0-16%(V) | [Water Solubility ]
Miscible with water, ethanol, diethyl ether, acetone, benzene, methanol, methyl acetate, ethyl acetate, acetamide solutions, chloroform, carbon tetrachloride, ethylene chloride and unsaturated hydrocarbons. Immiscible with saturated hydrocarbons. | [Sensitive ]
Hygroscopic | [Detection Methods]
NMR | [Merck ]
14,70 | [BRN ]
1740230 | [Exposure limits]
NIOSH: IDLH 25 mg/m3 | [InChIKey]
WEVYAHXRMPXWCK-FIBGUPNXSA-N | [CAS DataBase Reference]
2206-26-0(CAS DataBase Reference) | [Storage Precautions]
Store under nitrogen |
| Safety Data | Back Directory | [Hazard Codes ]
T,F,Xn | [Risk Statements ]
R11:Highly Flammable.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36:Irritating to the eyes.
R36/37/38:Irritating to eyes, respiratory system and skin .
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
R10:Flammable. | [Safety Statements ]
S16:Keep away from sources of ignition-No smoking .
S36/37:Wear suitable protective clothing and gloves .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S27:Take off immediately all contaminated clothing . | [RIDADR ]
UN 1993 3/PG 3
| [WGK Germany ]
3
| [F ]
10 | [Autoignition Temperature]
525 °C | [HazardClass ]
3 | [PackingGroup ]
II | [HS Code ]
28459000 | [Toxicity]
LD50 orally in Rabbit: 2730 - 3800 mg/kg LD50 dermal Rabbit 988 mg/kg |
| Hazard Information | Back Directory | [Chemical Properties]
colourless liquid | [Uses]
Acetonitrile-d3 is used as a polar aprotic solvent in organic synthesis.
| [Definition]
ChEBI: Acetonitrile-d3 is a deuterated compound. | [General Description]
Acetonitrile-d3 (Trideuteroacetonitrile, CD3CN) is a deuterated NMR (Nuclear Magnetic Resonance) solvent. Molecular rotational friction coefficient and magnetic relaxation times (T1) for 14N and 2D of CD3CN have been determined. It participates as solvent during the synthesis of 2-phenylindole. It serves as solvent for 1H NMR (Proton Nuclear Magnetic Resonance) and 13C NMR (Carbon-13 Nuclear Magnetic Resonance) spectral studies. |
|
|