1-Phenyl-2-Nitro-1-Propene

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Properties Simple | Detailed

Formula C9H9NO2
IUPAC Name [(e)-2-nitroprop-1-enyl]benzene
Molecular Mass 163.173 g·mol−1
Heat of Formation 89.7 ± 16.7 kJ·mol−1
Dipole Moment 5.02 ± 1.08 D
Volume 198.26 Å 3
Surface Area 194.8 Å 2
HOMO Energy -10.01 ± 0.55 eV
LUMO Energy 1.89 ± eV
Point Group Symmetry C1
Synonyms
  • (2-nitro-1-propenyl)benzene
  • (2-nitropropenyl)benzene
  • .beta.-methyl-.beta.-nitrostyrene
  • 1-(2-nitropropenyl)benzene
  • 1-phenyl-2-nitropropene
  • 2-nitro-1-phenyl-1-propene
  • 2-nitroprop-1-enylbenzene
  • [(e)-2-nitroprop-1-enyl]benzene
  • benzene, (2-nitro-1-propenyl)-
  • benzene, (2-nitropropenyl)-
  • benzene, (2-nitropropenyl)- (8ci)
  • benzene, 1-(2-nitropropenyl)-
  • benzene, 2-nitropropenyl-
  • beta-methyl-beta-nitrostyrene
  • caswell no. 604
  • epa pesticide chemical code 056302
  • hydroxy-[(e)-1-methyl-2-phenyl-vinyl]-oxoniumylidene-ammonium
  • hydroxy-[(e)-1-methyl-2-phenylvinyl]-oxoniumylideneammonium
  • hydroxy-oxoniumylidene-[(e)-1-phenylprop-1-en-2-yl]azanium
  • sr-01000638917-1
  • trans-beta-methyl-beta-nitrostyrene
CAS Number(s)
  • 705-60-2
InChIKey WGSVFWFSJDAYBM-BQYQJAHWSA-N
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