3-(4,6-Dichloro-2-Carboxyindol-3-Yl)Propionic Acid

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Properties Simple | Detailed

Formula C12H9Cl2NO4
IUPAC Name 3-(2-carboxyethyl)-4,6-dichloro-1h-indole-2-carboxylic acid
Molecular Mass 302.110 g·mol−1
Heat of Formation -711.8 ± 16.7 kJ·mol−1
Dipole Moment 4.16 ± 1.08 D
Volume 304.79 Å 3
Surface Area 272.08 Å 2
HOMO Energy -9.32 ± 0.55 eV
LUMO Energy 1.58 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(2-carboxyethyl)-4,6-dichloro-1h-indole-2-carboxylic acid
  • biomol-nt_000207
  • bpbio1_001266
  • oprea1_596892
  • sew 06645
InChIKey KNBSYZNKEAWABY-UHFFFAOYSA-N
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