3-[(3R)-5-Fluoro-2,3-Dihydro-1H-Indol-3-Yl]-L-Alanine

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Properties Simple | Detailed

Formula C11H13FN2O2
IUPAC Name (2s)-2-amino-3-[(3r)-5-fluoroindolin-3-yl]propanoic acid
Molecular Mass 224.232 g·mol−1
Heat of Formation -472.1 ± 16.7 kJ·mol−1
Dipole Moment 3.81 ± 1.08 D
Volume 260.23 Å 3
Surface Area 240.65 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy -0.19 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-3-[(3r)-5-fluoro-2,3-dihydro-1h-indol-3-yl]propanoic acid
  • (2s)-2-amino-3-[(3r)-5-fluoro-3-indolinyl]propanoic acid
  • (2s)-2-amino-3-[(3r)-5-fluoroindolin-3-yl]propanoic acid
  • (2s)-2-amino-3-[(3r)-5-fluoroindolin-3-yl]propionic acid
  • 2,3-dihydro-5-fluoro-l-tryptophan
  • 2,3-dihydro-5-fluorotryptophan
CAS Number(s)
  • 102978-36-9
InChIKey CJMQLNVSLQWZMU-RCOVLWMOSA-N
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