3-({3-Methyl-2-[(2,3,4-Trifluorophenoxy)Methyl]-1-Benzofuran-4-Yl}Oxy)-N-(3-Pyridinylmethyl)-1-Propanamine

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Properties Simple | Detailed

Formula C25H23F3N2O3
IUPAC Name 3-[3-methyl-2-[(2,3,4-trifluorophenoxy)methyl]benzofuran-4-yl]oxy-n-(3-pyridylmethyl)propan-1-amine
Molecular Mass 456.457 g·mol−1
Heat of Formation -638.7 ± 16.7 kJ·mol−1
Dipole Moment 8.91 ± 1.08 D
Volume 524.38 Å 3
Surface Area 473.84 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy -0.91 ± eV
Point Group Symmetry C1
Synonyms
  • 3-[3-methyl-2-[(2,3,4-trifluorophenoxy)methyl]benzofuran-4-yl]oxy-n-(3-pyridylmethyl)propan-1-amine
  • 3-[3-methyl-2-[(2,3,4-trifluorophenoxy)methyl]benzofuran-4-yl]oxypropyl-(3-pyridylmethyl)amine
  • 3-[[3-methyl-2-[(2,3,4-trifluorophenoxy)methyl]-1-benzofuran-4-yl]oxy]-n-(pyridin-3-ylmethyl)propan-1-amine
  • 3-[[3-methyl-2-[(2,3,4-trifluorophenoxy)methyl]-4-benzofuranyl]oxy]-n-(3-pyridylmethyl)propan-1-amine
  • 3-pyridinemethanamine, n-[3-[[3-methyl-2-[(2,3,4-trifluorophenoxy)methyl]-4-benzofuranyl]oxy]propyl]-
  • ro-09-4879
  • ro-0904879
InChIKey FKIAZUIISXQFHC-UHFFFAOYSA-N
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