3-(3-Carboxy-4-Hydroxyphenyl)-2-Phenyl-4,5-Dihydro-3H-Benz[E]Indole

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Properties Simple | Detailed

Formula C25H19NO3
IUPAC Name 2-hydroxy-5-(2-phenyl-4,5-dihydrobenzo[e]indol-3-ium-3a-ylium-3-yl)benzoic acid
Molecular Mass 381.423 g·mol−1
Heat of Formation -154.2 ± 16.7 kJ·mol−1
Dipole Moment 3.16 ± 1.08 D
Volume 447.95 Å 3
Surface Area 379.64 Å 2
HOMO Energy -8.16 ± 0.55 eV
LUMO Energy -0.98 ± eV
Point Group Symmetry C1
Synonyms
  • 2-hydroxy-5-(2-phenyl-4,5-dihydro-3h-benzo[e]indol-3-yl)benzoic acid
  • 2-hydroxy-5-(2-phenyl-4,5-dihydrobenzo[e]indol-3-yl)benzoic acid
  • 3-(3-carboxy-4-hydroxyphenyl)-2-phenyl-4,5-dihydro-3h-benz(e)indole
  • 5-(4,5-dihydro-2-phenyl-3h-benz(e)indol-3-yl)-2-hydroxybenzoic acid
  • 5-(4,5-dihydro-2-phenyl-3h-benz(e)indol-3-yl)salicylic acid
  • 5-(4,5-dihydro-2-phenyl-3h-benz[e]indol-3-yl)salicylic acid
  • alnovin
  • benzoic acid, 5-(4, {5-dihydro-2-phenyl-3h-benz[e]indol-3-yl)-2-hydroxy-}
  • benzoic acid, 5-(4,5-dihydro-2-phenyl-3h-benz(e)indol-3-yl)-2-hydroxy-
  • benzoic acid, 5-(4,5-dihydro-2-phenyl-3h-benz[e]indol-3-yl)-2-hydroxy-
  • d04145
  • fendosal
  • fendosal (usan)
  • hp 129
  • hp-129
  • p 71-0129
  • {5-(4,5-dihydro-2-phenyl-3h-benz[e]indol-3-yl)salicylic} acid
CAS Number(s)
  • 53597-27-6
InChIKey HAWWPSYXSLJRBO-UHFFFAOYSA-N
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