(1R,2S)-2-(Dimethylamino)-1,2,3,4-Tetrahydro-1-Naphthalenyl Benzoate

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Properties Simple | Detailed

Formula C19H21NO2
IUPAC Name [(1r,2s)-2-(dimethylamino)tetralin-1-yl] benzoate
Molecular Mass 295.376 g·mol−1
Heat of Formation -164.4 ± 16.7 kJ·mol−1
Dipole Moment 2.07 ± 1.08 D
Volume 367.37 Å 3
Surface Area 318.29 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy -0.40 ± eV
Point Group Symmetry C1
Synonyms
  • 1-naphthalenol, 2-(dimethylamino)-1,2,3,4-tetrahydro-, benzoate (ester), cis-(+-)-
  • [(1r,2s)-2-dimethylamino-1,2,3,4-tetrahydronaphthalen-1-yl] benzoate
  • [(1r,2s)-2-dimethylaminotetralin-1-yl] benzoate
  • benzoic acid [(1r,2s)-2-dimethylamino-1-tetralinyl] ester
  • benzoic acid [(1r,2s)-2-dimethylaminotetralin-1-yl] ester
  • dl-cis-1-benzoyloxy-2-dimethylamino-1,2,3,4-tetrahydronaphthalene
  • yau 17
  • yau-17
CAS Number(s)
  • 60036-90-0
InChIKey LBQGJHNNGUZLOH-ZWKOTPCHSA-N
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