1-Trimethylammonio-3-(3-Indolyl)Propionate

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Properties Simple | Detailed

Formula C14H18N2O2
IUPAC Name (2s)-3-(1h-indol-3-yl)-2-(trimethylammonio)propanoate
Molecular Mass 246.305 g·mol−1
Heat of Formation -115.5 ± 16.7 kJ·mol−1
Dipole Moment 11.75 ± 1.08 D
Volume 307.73 Å 3
Surface Area 264.24 Å 2
HOMO Energy -8.20 ± 0.55 eV
LUMO Energy 0.13 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-3-(1h-indol-3-yl)-2-trimethylammonio-propanoate
  • (2s)-3-(1h-indol-3-yl)-2-trimethylammonio-propionate
  • (2s)-3-(1h-indol-3-yl)-2-trimethylammoniopropanoate
  • (2s)-3-(1h-indol-3-yl)-2-trimethylazaniumyl-propanoate
  • (2s)-3-(1h-indol-3-yl)-2-trimethylazaniumylpropanoate
  • hypaphorine
CAS Number(s)
  • 487-58-1
InChIKey AOHCBEAZXHZMOR-ZDUSSCGKSA-N
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