Erythro-3,4-Dihydroxyphenyl-2-Piperidinylcarbinol

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Properties Simple | Detailed

Formula C12H17NO3
IUPAC Name 4-[(s)-hydroxy-[(2r)-2-piperidyl]methyl]benzene-1,2-diol
Molecular Mass 223.268 g·mol−1
Heat of Formation -496.3 ± 16.7 kJ·mol−1
Dipole Moment 2.00 ± 1.08 D
Volume 268.73 Å 3
Surface Area 248.06 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy 2.87 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2-benzenediol, 4-(hydroxy-2-piperidinylmethyl)-, (r*,s*)-
  • 3,4-dihydroxy-alpha-(2-piperidyl)benzylalkohol
  • 4-(hydroxy-2-piperidinylmethyl)-1,2-benzenediol
  • 4-[(s)-hydroxy-[(2r)-2-piperidinyl]methyl]benzene-1,2-diol
  • 4-[(s)-hydroxy-[(2r)-2-piperidyl]methyl]benzene-1,2-diol
  • 4-[(s)-hydroxy-[(2r)-2-piperidyl]methyl]pyrocatechol
  • 4-[(s)-hydroxy-[(2r)-piperidin-2-yl]methyl]benzene-1,2-diol
  • alpha-(3,4-dihydroxyphenyl)-2-piperidinemethanol
  • rimiterol
CAS Number(s)
  • 32953-89-2
InChIKey IYMMESGOJVNCKV-SKDRFNHKSA-N
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