(βs)-β-Methyl-D-Tryptophan

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Properties Simple | Detailed

Formula C12H14N2O2
IUPAC Name (2r,3s)-2-amino-3-(1h-indol-3-yl)butanoic acid
Molecular Mass 218.252 g·mol−1
Heat of Formation -240.9 ± 16.7 kJ·mol−1
Dipole Moment 3.03 ± 1.08 D
Volume 266.67 Å 3
Surface Area 237.55 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy -0.08 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s)-2-amino-3-(1h-indol-3-yl)butanoic acid
  • (2r,3s)-2-amino-3-(1h-indol-3-yl)butyric acid
InChIKey CZSQAYAIWDEOSA-WRWORJQWSA-N
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