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

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Properties Simple | Detailed

Formula C14H18F3NO3S
IUPAC Name [(3r)-3-(propylamino)tetralin-5-yl] trifluoromethanesulfonate
Molecular Mass 337.358 g·mol−1
Heat of Formation -1095.1 ± 16.7 kJ·mol−1
Dipole Moment 3.26 ± 1.08 D
Volume 367.02 Å 3
Surface Area 320.85 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy -1.16 ± eV
Point Group Symmetry C1
Synonyms
  • 8-(((trifluoromethyl)sulfonyl)oxy)-2-(n-propylamino)tetralin
  • 8-so2cf3-pat
  • [(3r)-3-propylaminotetralin-5-yl] trifluoromethanesulfonate
  • [(7r)-7-propylamino-5,6,7,8-tetrahydronaphthalen-1-yl] trifluoromethanesulfonate
  • methanesulfonic acid, trifluoro-, 5,6,7,8-tetrahydro-7-(propylamino)-1-naphthalenyl ester, (r)-
  • r-(+)-8-oso2cf3-pat
  • trifluoromethanesulfonic acid [(3r)-3-propylamino-5-tetralinyl] ester
  • trifluoromethanesulfonic acid [(3r)-3-propylaminotetralin-5-yl] ester
CAS Number(s)
  • 161970-95-2
InChIKey ZRWGXXAMGVLDQT-LLVKDONJSA-N
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