Acetonitrile-d3, 10 X 1 ML

SKU:
151807-10X1ML
  • $97.90

    • Description

    Acetonitrile-d3, ≥99.8 atom % D, 10 X 1 ML

    Synonym(s):
    Methyl-d3 cyanide, Trideuteroacetonitrile
    Linear Formula:
    CD3CN
    CAS Number:
    2206-26-0
    Molecular Weight:
    44.07
    Beilstein:
    1740230
    EC Number:
    218-616-5
    MDL number:
    MFCD00001881
    PubChem Substance ID:
    24848856
    NACRES:
    NA.21

    Quality Level

    200

    isotopic purity

    ≥99.8 atom % D

    assay

    ≥99% (CP)

    form

    liquid

    expl. lim.

    3.0-16 % (lit.)

    technique(s)

    NMR: suitable

    impurities

    ≤0.0200% water
    water

    refractive index

    n20/D 1.341 (lit.)

    bp

    80.7 °C (lit.)

    mp

    -46 °C (lit.)

    density

    0.844 g/mL at 25 °C (lit.)

    mass shift

    M+3

    SMILES string

    [2H]C([2H])([2H])C#N

    InChI

    1S/C2H3N/c1-2-3/h1H3/i1D3

    InChI key

    WEVYAHXRMPXWCK-FIBGUPNXSA-N

    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.

    Application

    Acetonitrile-d3 has been used as a deuterated solvent for the dissolution of internal standard and sample in qNMR (Quantitative Nuclear Magnetic Resonance) quantification experiments. It has also been used as the deuterated solvent in the synthesis of N-methyl indolylfulgimide, which is studied using UV-pump-IR-probe spectroscopy.

    Packaging

    5, 10 g in ampule
    10×0.6, 10×0.75, 10×1 mL in ampule
    100 g in Sure/Seal™
    10, 25, 50 g in glass bottle

    Pictograms

    GHS02,GHS06

    Signal Word

    Danger

    Hazard Statements

    H225 - H302 + H312 - H319 - H331

    Precautionary Statements

    P210 - P280 - P301 + P312 - P303 + P361 + P353 - P304 + P340 + P311 - P305 + P351 + P338

    Hazard Classifications

    Acute Tox. 3 Inhalation - Acute Tox. 4 Dermal - Acute Tox. 4 Oral - Eye Irrit. 2 - Flam. Liq. 2

    Storage Class Code

    3 - Flammable liquids

    WGK

    WGK 2

    Flash Point(F)

    35.6 °F - closed cup

    Flash Point(C)

    2.00 °C - closed cup