N'-(2,4-Dinitrophenyl)-N-Methyl-N-(2-Propyn-1-Yl)-1,3-Propanediamine

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Properties Simple | Detailed

Formula C13H16N4O4
IUPAC Name n-(2,4-dinitrophenyl)-n'-methyl-n'-prop-2-ynyl-propane-1,3-diamine
Molecular Mass 292.291 g·mol−1
Heat of Formation 255.3 ± 16.7 kJ·mol−1
Dipole Moment 10.65 ± 1.08 D
Volume 341.02 Å 3
Surface Area 298.44 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy -1.31 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-propanediamine, n'-(2,4-dinitrophenyl)-n-methyl-n-2-propynyl-
  • 3-[(2,4-dinitrophenyl)amino]propyl-methyl-propargyl-amine
  • dinitranyl
  • n'-(2,4-dinitrophenyl)-n-methyl-n-prop-2-ynyl-propane-1,3-diamine
  • n'-(2,4-dinitrophenyl)-n-methyl-n-prop-2-ynylpropane-1,3-diamine
CAS Number(s)
  • 83711-65-3
InChIKey UPNZJMVYFNCDSO-UHFFFAOYSA-N
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