N-[(2R,3S)-3-Amino-2-Hydroxy-4-Phenylbutyl]-4-Methoxy-2,3,6-Trimethylbenzenesulfonamide

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Properties Simple | Detailed

Formula C20H28N2O4S
IUPAC Name n-[(2r,3s)-3-amino-2-hydroxy-4-phenyl-butyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide
Molecular Mass 392.512 g·mol−1
Heat of Formation -633.2 ± 16.7 kJ·mol−1
Dipole Moment 5.98 ± 1.08 D
Volume 472.08 Å 3
Surface Area 403.65 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy 2.88 ± eV
Point Group Symmetry C1
Synonyms
  • c4m
  • n-[(2r,3s)-3-amino-2-hydroxy-4-phenyl-butyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide
InChIKey HORGTFOBJRCVMO-ZWKOTPCHSA-N
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