N-[2-(2-Bromo-5-Methoxy-1H-Indol-3-Yl)Ethyl]Acetamide

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Properties Simple | Detailed

Formula C13H15BrN2O2
IUPAC Name n-[2-(2-bromo-5-methoxy-1h-indol-3-yl)ethyl]acetamide
Molecular Mass 311.174 g·mol−1
Heat of Formation -235.4 ± 16.7 kJ·mol−1
Dipole Moment 4.05 ± 1.08 D
Volume 317.89 Å 3
Surface Area 273.28 Å 2
HOMO Energy -8.61 ± 0.55 eV
LUMO Energy -0.52 ± eV
Point Group Symmetry C1
Synonyms
  • 2-bromomelatonin
  • acetamide, n-(2-(2-bromo-5-methoxy-1h-indol-3-yl)ethyl)-
  • n-(2-(2-bromo-5-methoxy-1h-indol-3-yl)ethyl)acetamide
  • n-[2-(2-bromo-5-methoxy-1h-indol-3-yl)ethyl]ethanamide
  • pdsp1_001793
  • pdsp2_001776
CAS Number(s)
  • 142959-59-9
InChIKey FNHLXIXCQDGUCQ-UHFFFAOYSA-N
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Elements H C O Br N