(7R)-7-Methyl-3-(2-Propyn-1-Yloxy)-4,5,6,7-Tetrahydro[1,2]Thiazolo[4,5-C]Pyridine

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Properties Simple | Detailed

Formula C10H12N2OS
IUPAC Name (7r)-7-methyl-3-prop-2-ynoxy-4,5,6,7-tetrahydroisothiazolo[4,5-c]pyridine
Molecular Mass 208.280 g·mol−1
Heat of Formation 241.3 ± 16.7 kJ·mol−1
Dipole Moment 2.66 ± 1.08 D
Volume 248.85 Å 3
Surface Area 237.59 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy 2.57 ± eV
Point Group Symmetry C1
Synonyms
  • (7r)-7-methyl-3-prop-2-ynoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[5,4-d]pyridine
  • (7r)-7-methyl-3-prop-2-ynoxy-4,5,6,7-tetrahydroisothiazolo[5,4-d]pyridine
  • (7r)-7-methyl-3-propargyloxy-4,5,6,7-tetrahydroisothiazolo[5,4-d]pyridine
  • 7-methyl-3-(2-propynyloxy)-4,5,6,7-tetrahydroisothiazolo(4,5-c)pyridine
  • isothiazolo(4,5-c)pyridine, 4,5,6,7-tetrahydro-7-methyl-3-(2-propynyloxy)-, (-)-
  • lu 26-046
  • lu-26-046
CAS Number(s)
  • 143756-51-8
InChIKey TUJJAFCGWFLDFE-SSDOTTSWSA-N
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