[1-(4-Chlorobenzoyl)-5-(Dimethylamino)-2-Methyl-1H-Indol-3-Yl]Acetic Acid

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Properties Simple | Detailed

Formula C20H19ClN2O3
IUPAC Name 2-[1-(4-chlorobenzoyl)-5-(dimethylamino)-2-methyl-indol-1-ium-3-yl]acetic acid
Molecular Mass 370.829 g·mol−1
Heat of Formation -340.5 ± 16.7 kJ·mol−1
Dipole Moment 3.08 ± 1.08 D
Volume 431.32 Å 3
Surface Area 369.98 Å 2
HOMO Energy -8.33 ± 0.55 eV
LUMO Energy -1.00 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(4-chlorobenzoyl)-5-dimethylamino-2-methylindole acetic acid
  • 1-(p-chlorobenzoyl)-5-dimethylamino-2-methylindole acetic acid
  • 1-4-chlorobenzoyl-2-methyl-5-dimethylaminoindole-3-acetic acid hydrochloride hem
  • 1h-indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-(dimethylamino)-2-methyl-
  • 2-[1-(4-chlorobenzoyl)-5-dimethylamino-2-methyl-indol-3-yl]acetic acid
  • 2-[1-(4-chlorobenzoyl)-5-dimethylamino-2-methylindol-3-yl]acetic acid
  • 2-[1-(4-chlorophenyl)carbonyl-5-dimethylamino-2-methyl-indol-3-yl]ethanoic acid
  • 2-[1-[(4-chlorophenyl)-oxomethyl]-5-dimethylamino-2-methyl-3-indolyl]acetic acid
  • mk 825
CAS Number(s)
  • 31915-16-9
  • 23456-71-5
  • 23298-10-4
InChIKey SUSOIBZGVNNEFL-UHFFFAOYSA-N
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Elements H C N O Cl