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HomeProduct name listNITROMETHANE-D3

NITROMETHANE-D3

Synonym(s):Trideuteronitromethane

  • CAS NO.:13031-32-8
  • Empirical Formula: CD3NO2
  • Molecular Weight: 64.06
  • MDL number: MFCD00044214
  • EINECS: 235-892-2
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2023-05-04 17:34:32
NITROMETHANE-D3 Structural

What is NITROMETHANE-D3?

Chemical properties

colourless liquid

Definition

ChEBI: Nitromethane-d3 is a deuterated compound, a primary nitroalkane and a volatile organic compound.

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 asymetrical 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.

Properties of NITROMETHANE-D3

Melting point: -29°C
Boiling point: 100 °C(lit.)
Density  1.183 g/mL at 25 °C(lit.)
refractive index  n20/D 1.3795(lit.)
Flash point: 95 °F
storage temp.  Store at +15°C to +25°C.
solubility  117g/l
form  Liquid
color  Colorless
explosive limit 7.1-63%(V)
Sensitive  Hygroscopic
BRN  1751076
Exposure limits ACGIH: TWA 20 ppm
OSHA: TWA 100 ppm(250 mg/m3)
NIOSH: IDLH 750 ppm
Stability: May detonate if sensitized by amines, alkalies, strong acids, high temperatures or adiabatic compression. The dry alkali or amine salts are shock-sensitive and the sodium salt ignites on contact with water. Flammable. Incompatible with amines, strong acids, strong bases, strong oxidizing agents, strong reducing agents, copper, copper alloys,
CAS DataBase Reference 13031-32-8(CAS DataBase Reference)

Safety information for NITROMETHANE-D3

Signal word Warning
Pictogram(s)
ghs
Flame
Flammables
GHS02
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H226:Flammable liquids
H302:Acute toxicity,oral
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P233:Keep container tightly closed.
P240:Ground/bond container and receiving equipment.
P241:Use explosion-proof electrical/ventilating/lighting/…/equipment.
P242:Use only non-sparking tools.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.

Computed Descriptors for NITROMETHANE-D3

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