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Dimethylmethane

CAS No.: 74-98-6

  • Molecular Formula: CH3CH2CH3
  • Molecular Weight: 44.10 g/mol

Chemical type

  • Hydrocarbon fuel
  • Alkane
Cite 1
  • Light alkane
  • Saturated hydrocarbon feedstock
Cite 2

Key properties

  • Medium-sized fuel molecule with moderate compression levels (q_min^CPU = q_min^acc = 60)
  • Similar source term error trends to methane due to shared kinetic mechanisms
  • Activates full reaction pathway in C1C3 mechanism, slightly limiting reduction compared to methane
  • Combusted in air mixtures with equivalence ratios (φ) from 0.3 to 1.5 and initial temperatures (T₀) from 1200 K to 1800 K
Cite 1
  • Chemically stable C–H bonds
  • Requires catalytic activation
  • Non-polar molecule
Cite 2
  • Fuel in 0D constant-pressure batch reactor simulations
  • Validation of LV framework for handling detailed chemistry
  • Employed to evaluate solver performance across lumped and detailed mechanisms
  • Used to achieve computational speed-ups (up to 45.4% with detailed mechanisms, average ~2x overall)
Cite 1
  • Feedstock for dehydrogenation reactions
  • Precursor for propene production
Cite 2

Classification by use

  • Fuels used in reduced-order combustion modeling
  • Chemicals simulated with lumped mechanisms (CRECK C1C3: 111 species, 1998 reactions)
  • Chemicals simulated with detailed mechanisms (Aramco V1.3: 251 species, 1537 reactions)
  • Substances for comparing latent solver accuracy and efficiency in reacting flows
Cite 1
  • Chemicals used as petrochemical feedstocks
  • Chemicals used in alkane dehydrogenation
Cite 2

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  1. [Cite 1] A latent variable framework for handling detailed chemistry in reacting flows, Applications in Energy and Combustion Science, Volume 25, March 2026, 100430
  2. [Cite 2] The influence of metal/heteroelement in the M-BEA (M = Ga(Ta, Nb), Cr, Zn (Y)) zeolites on their catalytic properties in the PDH-CO2 process, Applied Catalysis O: Open, Volume 209, December 2025, 207081