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Nitromethane-D3 99 Atom% D 10 gram

Synonym: Trideuteronitromethane

• CAS Number 13031-32-8
• Linear Formula CD3NO2
• Molecular Weight 64.06
• Beilstein/REAXYS Number 1751076
• EC Number 235-892-2
• MDL number MFCD00044214
• PubChem Substance ID 24849185

InChI Key LYGJENNIWJXYER-FIBGUPNXSA-N Isotopic Purity 99 atom % D Assay 99% (CP) Expl. Lim. 7.1-63 % ((lit.)) Impurities

≤0.1000% water
water

Refractive Index n20/D 1.3795 (lit.) bp 100°C(lit.) mp -29°C (lit.) Density 1.183 g/mL at 25°C (lit.) Mass Shift M+3

General description

Nitromethane-d3 is a deuterated derivative of nitromethane. Its pyrolytic decomposition in the absence and presence of nitrogen dioxide have been studied. Molecular structure studies suggest that its molecule is composed of a highly asymmetrical top consisting of a heavy planar frame of NO2 (C2v symmetry) and a lighter top of CD3 (C3v symmetry). Rotational constants, high-resolution Fourier transform infrared (FTIR) spectrum and DFT (Density Functional Theory) calculations of nitromethane-d3 have been evaluated. Various physicochemical properties (densities, viscosities, speed of sound and refractive indices) of CD3NO2 have been evaluated in the temperature range of 293K to 308K.

Safety Information

GHS08, GHS06, GHS08

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Signal word Danger

Hazard statements H226-H302-H331-H351
Precautionary statements P210-P261-P280-P304 + P340 + P312-P370 + P378-P403 + P233
RIDADR UN1261 - class 3 - PG 2 - Nitromethane
WGK Germany 2
Flash Point(F) 95°F
Flash Point(C) 35°C

Documents

Safety Data Sheet

Warnings

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