ACETONITRILE-D3

ACETONITRILE-D3 Basic information

Product Name:	ACETONITRILE-D3
Synonyms:	DEUTERATED ACETONITRILE;[2H3]acetonitrile;Acetonitrile-d₃;Acetonitrile-d₃;Acetonitriledisotopicpurity;ACETONITRILE-D3, 99.8 ATOM % D (CONTAINS;ACETONITRILE-D3,99.8 ATOM % D (CONTAINSAP PROXIMATELY 15-20% D2O);ACETONITRILE-D3, ISOTOPIC PURITY 99%
CAS:	2206-26-0
MF:	C2H3N
MW:	41.05
EINECS:	218-616-5
Product Categories:	Acetonitrile-d3;Acetonitrile and Acetonitrile Solutions;Air-Sensitive NMR;Anhydrous NMR Solvents;Anhydrous NMR Solvents for Air Sensitive NMR;Labware;NMR;NMR Solvents;NMR Solvents and Reagents;Solvent by Application;Solvent by Type;Solvents;Specialty NMR Solvents;Spectroscopy Solvents (IR;Analytical Chemistry;Deuterated Compounds for NMR;NMR Spectrometry;Stable Isotopes;Tubes and Accessories;UV/Vis);A;Aldrich High Purity NMR Solvents for Routine NMR;Alphabetical Listings;High Throughput NMR;Routine NMR;Solvents for High Throughput NMR;Aldrich 100% NMR Solvents for High Resolution;High Resolution NMR
Mol File:	2206-26-0.mol

ACETONITRILE-D3 Chemical Properties

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.	Store below +30°C.
solubility	soluble in Most Organic Solvents
form	Liquid In Prescored Ampoules, (0.75Ml/ampoule)
color	Colorless
Specific Gravity	0.844
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
Merck	14,70
BRN	1740230
Exposure limits	NIOSH: IDLH 25 mg/m3
Stability:	Stable. Flammable. Incompatible with strong oxidizing agents, strong acids.
InChIKey	WEVYAHXRMPXWCK-FIBGUPNXSA-N
CAS DataBase Reference	2206-26-0(CAS DataBase Reference)

Safety Information

Hazard Codes	T,F,Xn
Risk Statements	11-20/21/22-36-36/37/38-23/24/25-10
Safety Statements	16-36/37-45-27-26
RIDADR	UN 1993 3/PG 3
WGK Germany	3
F	10
Autoignition Temperature	525 °C
HS Code	2845 90 10
HazardClass	3
PackingGroup	II
Toxicity	LD50 orally in Rabbit: 2730 - 3800 mg/kg LD50 dermal Rabbit 988 mg/kg

MSDS Information

ACETONITRILE-D3 Usage And Synthesis

Chemical Properties	colourless liquid
Uses	Acetonitrile-d3 is used as a polar aprotic solvent in organic synthesis.
Uses	Isotope labeled Acetonitrile is used as a polar aprotic solvent in organic synthesis. Acetonitrile-d3 is used as IR and NMR solvent. Probe for zeolite acidity. Cartridge eluent in HPLC- SPE (solid-phase extraction)-NMR technique.
Uses	Acetonitrile-d₃ may be used as: IR and NMR solvent. Probe for zeolite acidity. Cartridge eluent in HPLC– SPE (solid-phase extraction)–NMR technique.
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.

ACETONITRILE-D3 Preparation Products And Raw materials

Preparation Products

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