5-Bromo-4-Chloro-1H-Indol-3-Yl Acetate

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Properties Simple | Detailed

Formula C10H7BrClNO2
IUPAC Name (5-bromo-4-chloro-indol-1-ium-3-yl) acetate
Molecular Mass 288.525 g·mol−1
Heat of Formation -197.8 ± 16.7 kJ·mol−1
Dipole Moment 2.66 ± 1.08 D
Volume 252.75 Å 3
Surface Area 237.79 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy -0.68 ± eV
Point Group Symmetry C1
Synonyms
  • (5-bromo-4-chloro-1h-indol-3-yl) acetate
  • (5-bromo-4-chloro-1h-indol-3-yl) ethanoate
  • 1h-indol-3-ol, 5-bromo-4-chloro-, acetate (ester)
  • 5-bromo-4-chloro-3-indolyl acetate
  • 5-bromo-4-chloroindoxyl acetate
  • acetic acid (5-bromo-4-chloro-1h-indol-3-yl) ester
  • bcda
CAS Number(s)
  • 3252-36-6
InChIKey WPWLFFMSSOAORQ-UHFFFAOYSA-N
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Elements C Cl H O N Br