(7S)-7-(Propylamino)-5,6,7,8-Tetrahydro-1-Naphthalenyl Trifluoromethanesulfonate

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Properties Simple | Detailed

Formula C14H18F3NO3S
IUPAC Name [(3s)-3-(propylamino)tetralin-5-yl] trifluoromethanesulfonate
Molecular Mass 337.358 g·mol−1
Heat of Formation -1095.4 ± 16.7 kJ·mol−1
Dipole Moment 3.23 ± 1.08 D
Volume 366.44 Å 3
Surface Area 321.58 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -1.15 ± eV
Point Group Symmetry C1
Synonyms
  • [(3s)-3-propylaminotetralin-5-yl] trifluoromethanesulfonate
  • [(7s)-7-propylamino-5,6,7,8-tetrahydronaphthalen-1-yl] trifluoromethanesulfonate
  • trifluoromethanesulfonic acid [(3s)-3-propylamino-5-tetralinyl] ester
  • trifluoromethanesulfonic acid [(3s)-3-propylaminotetralin-5-yl] ester
InChIKey ZRWGXXAMGVLDQT-NSHDSACASA-N
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