Fingolimod

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Properties Simple | Detailed

Formula C19H33NO2
IUPAC Name 2-amino-2-[2-(4-octylphenyl)ethyl]propane-1,3-diol
Molecular Mass 307.471 g·mol−1
Heat of Formation -524.5 ± 16.7 kJ·mol−1
Dipole Moment 3.26 ± 1.08 D
Volume 430.3 Å 3
Surface Area 392.55 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy -0.08 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-2-(4-octylphenethyl)propane-1,3-diol
InChIKey KKGQTZUTZRNORY-UHFFFAOYSA-N
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