5,5-Dimethyl-2-Morpholin-4-Yl-5,6-Dihydro-4H-Benzothiazol-7-One

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Properties Simple | Detailed

Formula C13H18N2O2S
IUPAC Name 5,5-dimethyl-2-morpholino-4,6-dihydro-1,3-benzothiazol-7-one
Molecular Mass 266.359 g·mol−1
Heat of Formation -268.7 ± 16.7 kJ·mol−1
Dipole Moment 3.27 ± 1.08 D
Volume 313.17 Å 3
Surface Area 275.54 Å 2
HOMO Energy -8.59 ± 0.55 eV
LUMO Energy 2.17 ± eV
Point Group Symmetry C1
Synonyms
  • 5,5-dimethyl-2-(4-morpholinyl)-5,6-dihydro-1,3-benzothiazol-7(4h)-one
  • 5,5-dimethyl-2-morpholin-4-yl-4,6-dihydro-1,3-benzothiazol-7-one
  • oprea1_021222
  • oprea1_045856
InChIKey DZXMARZBAUMWLK-UHFFFAOYSA-N
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