3-(5-Nitro-2-Furyl)-2-Propenal

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Properties Simple | Detailed

Formula C7H5NO4
IUPAC Name (e)-3-(5-nitro-2-furyl)prop-2-enal
Molecular Mass 167.119 g·mol−1
Heat of Formation -74.9 ± 16.7 kJ·mol−1
Dipole Moment 6.11 ± 1.08 D
Volume 183.14 Å 3
Surface Area 189.94 Å 2
HOMO Energy -10.18 ± 0.55 eV
LUMO Energy 1.03 ± eV
Point Group Symmetry Cs
Synonyms
  • (e)-3-(5-nitro-2-furyl)acrolein
  • (e)-3-(5-nitro-2-furyl)acrylaldehyde
  • (e)-3-(5-nitro-2-furyl)prop-2-enal
  • (e)-3-(5-nitrofuran-2-yl)prop-2-enal
  • 2-furanacrolein, 5-nitro-
  • 2-propenal, 3-(5-nitro-2-furanyl)-
  • 3-(5-nitro-2-furyl)acrolein
  • 3-(5-nitro-2-furyl)prop-2-enal
  • 3-(5-nitrofuran-2-yl)prop-2-enal
  • 5-nitro-2-furanacrolein
  • 5-nitro-2-furylacrolein
  • 5-nitrofuran-2-acrylaldehyde
  • 5-nitrofuryl-2-acrolein
CAS Number(s)
  • 52661-56-0
  • 1874-22-2
InChIKey DXWCZMGIIFEEPU-OWOJBTEDSA-N
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