(2E,6E)-8-[(3-Benzoylbenzyl)Oxy]-3,7-Dimethyl-2,6-Octadien-1-Yl Trihydrogen Diphosphate

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Properties Simple | Detailed

Formula C24H30O9P2
IUPAC Name [(2e,6e)-8-[(3-benzoylphenyl)methoxy]-3,7-dimethyl-octa-2,6-dienyl] phosphono hydrogen phosphate
Molecular Mass 524.437 g·mol−1
Heat of Formation -1999.6 ± 16.7 kJ·mol−1
Dipole Moment 4.90 ± 1.08 D
Volume 606.19 Å 3
Surface Area 526.52 Å 2
HOMO Energy -9.36 ± 0.55 eV
LUMO Energy 1.97 ± eV
Point Group Symmetry C1
Synonyms
  • (2e,6e)-8-[(3-benzoylbenzyl)oxy]-3,7-dimethylocta-2,6-dienyl trihydrogen diphosphate
  • 1nh
  • [(2e,6e)-3,7-dimethyl-8-[(3-phenylcarbonylphenyl)methoxy]octa-2,6-dienyl] phosphono hydrogen phosphate
  • [(2e,6e)-3,7-dimethyl-8-[[3-(oxo-phenylmethyl)phenyl]methoxy]octa-2,6-dienyl] phosphono hydrogen phosphate
  • [(2e,6e)-8-[3-(benzoyl)benzyl]oxy-3,7-dimethyl-octa-2,6-dienyl] phosphono hydrogen phosphate
  • [(2e,6e)-8-[[3-(benzoyl)phenyl]methoxy]-3,7-dimethyl-octa-2,6-dienyl] phosphono hydrogen phosphate
  • [(2e,6e)-8-[[3-(benzoyl)phenyl]methoxy]-3,7-dimethylocta-2,6-dienyl] phosphono hydrogen phosphate
  • [3,7-dimethyl-8-[(3-phenylcarbonylphenyl)methoxy]octa-2,6-dienyl] phosphono hydrogen phosphate
  • [3,7-dimethyl-8-[[3-(oxo-phenylmethyl)phenyl]methoxy]octa-2,6-dienyl] phosphono hydrogen phosphate
  • [8-[3-(benzoyl)benzyl]oxy-3,7-dimethyl-octa-2,6-dienyl] phosphono hydrogen phosphate
  • [8-[[3-(benzoyl)phenyl]methoxy]-3,7-dimethyl-octa-2,6-dienyl] phosphono hydrogen phosphate
  • [8-[[3-(benzoyl)phenyl]methoxy]-3,7-dimethylocta-2,6-dienyl] phosphono hydrogen phosphate
InChIKey IRMXEEMZDGNJKM-APFDVHGWSA-N
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