5-{(1R)-1-Hydroxy-2-[(2-Methyl-2-Propanyl)Amino]Ethyl}-1,3-Benzenediol

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Properties Simple | Detailed

Formula C12H19NO3
IUPAC Name 5-[(1r)-2-(tert-butylamino)-1-hydroxy-ethyl]benzene-1,3-diol
Molecular Mass 225.284 g·mol−1
Heat of Formation -571.1 ± 16.7 kJ·mol−1
Dipole Moment 3.30 ± 1.08 D
Volume 292.08 Å 3
Surface Area 265.69 Å 2
HOMO Energy -9.00 ± 0.55 eV
LUMO Energy 3.05 ± eV
Point Group Symmetry C1
Synonyms
  • 5-[(1r)-2-(tert-butylamino)-1-hydroxy-ethyl]benzene-1,3-diol
  • 5-[(1r)-2-(tert-butylamino)-1-hydroxy-ethyl]resorcinol
  • 5-[(1r)-2-(tert-butylamino)-1-hydroxyethyl]benzene-1,3-diol
InChIKey XWTYSIMOBUGWOL-NSHDSACASA-N
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