1-(6-(1-Aziridinyl)Hexyl)-2-(4-Hydroxyphenyl)-3-Methyl-1H-Indol-5-Ol

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Formula C23H28N2O2
IUPAC Name 1-[6-(aziridin-1-yl)hexyl]-2-(4-hydroxyphenyl)-3-methyl-indol-1-ium-2-ylium-5-ol
Molecular Mass 364.481 g·mol−1
Heat of Formation -88.9 ± 16.7 kJ·mol−1
Dipole Moment 3.85 ± 1.08 D
Volume 468.9 Å 3
Surface Area 414.45 Å 2
HOMO Energy -8.05 ± 0.55 eV
LUMO Energy -0.14 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(6-aziridinylhexyl)-2-(4-hydroxyphenyl)indol-5-ol
  • 1-(6-ethyleniminohexyl)-2-(4-hydroxyphenyl)-3-methyl-indol-5-ol
  • 1-[6-(1-aziridinyl)hexyl]-2-(4-hydroxyphenyl)-3-methyl-5-indolol
  • 1-[6-(aziridin-1-yl)hexyl]-2-(4-hydroxyphenyl)-3-methyl-indol-5-ol
  • 1-[6-(aziridin-1-yl)hexyl]-2-(4-hydroxyphenyl)-3-methylindol-5-ol
  • 1-ahpi
  • 1h-indol-5-ol, 1-(6-(1-aziridinyl)hexyl)-2-(4-hydroxyphenyl)-3-methyl-
CAS Number(s)
  • 130628-38-5
InChIKey WDUMAEIRQFPTMT-UHFFFAOYSA-N
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