3-Isopropoxy-5-Methoxy-1-Benzothiophene-2-Carboxamide

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Properties Simple | Detailed

Formula C13H15NO3S
IUPAC Name 3-isopropoxy-5-methoxy-benzothiophene-2-carboxamide
Molecular Mass 265.328 g·mol−1
Heat of Formation -409.1 ± 16.7 kJ·mol−1
Dipole Moment 6.34 ± 1.08 D
Volume 309.02 Å 3
Surface Area 273.44 Å 2
HOMO Energy -8.30 ± 0.55 eV
LUMO Energy -0.99 ± eV
Point Group Symmetry C1
Synonyms
  • 3-ipro-5-meo-bzt
  • 3-isopropoxy-5-methoxy-2-benzothiophenecarboxamide
  • 3-isopropoxy-5-methoxybenzo(b)thiophene-2-carboxamide
  • 5-methoxy-3-(1-methylethoxy)benzo(b)thiophene-2-carboxamide
  • 5-methoxy-3-propan-2-yloxy-1-benzothiophene-2-carboxamide
  • benzo(b)thiophene-2-carboxamide, 5-methoxy-3-(1-methylethoxy)-
CAS Number(s)
  • 104796-05-6
InChIKey YNXSDBVUOOEWIK-UHFFFAOYSA-N
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