4-(5-Methoxy-3-Methyl-1H-Indol-2-Yl)-2,6-Dimethylphenol

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Properties Simple | Detailed

Formula C18H19NO2
IUPAC Name 4-(5-methoxy-3-methyl-indol-1-ium-2-ylium-2-yl)-2,6-dimethyl-phenol
Molecular Mass 281.349 g·mol−1
Heat of Formation -189.1 ± 16.7 kJ·mol−1
Dipole Moment 2.94 ± 1.08 D
Volume 347.96 Å 3
Surface Area 319.19 Å 2
HOMO Energy -8.07 ± 0.55 eV
LUMO Energy -0.20 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(4-hydroxy-3,5-dimethylphenyl)-5-methoxy-3-methylindole
  • 4-(5-methoxy-3-methyl-1h-indol-2-yl)-2,6-dimethyl-phenol
  • phenol, 4-(5-methoxy-3-methyl-1h-indol-2-yl)-2,6-dimethyl-
  • tzi 41127
  • tzi-41127
CAS Number(s)
  • 104007-80-9
InChIKey OZFHUMGEWVYBRM-UHFFFAOYSA-N
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