5-{3-[2,6-Dimethyl-4-(2-Methyl-1,3-Oxazol-4-Yl)Phenoxy]Propyl}-3-Methylisoxazole

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Properties Simple | Detailed

Formula C19H22N2O3
IUPAC Name 4-[3,5-dimethyl-4-[3-(3-methylisoxazol-5-yl)propoxy]phenyl]-2-methyl-5h-oxazol-3-ium-5-ide
Molecular Mass 326.390 g·mol−1
Heat of Formation -162.4 ± 16.7 kJ·mol−1
Dipole Moment 4.31 ± 1.08 D
Volume 400.32 Å 3
Surface Area 374.66 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy -0.35 ± eV
Point Group Symmetry C1
Synonyms
  • 2,6-dimethyl-1-(3-[3-methyl-5-isoxazolyl]-propanyl)-4-[2-methyl-4-isoxazolyl]-phenol
  • 5-[3-[2,6-dimethyl-4-(2-methyl-1,3-oxazol-4-yl)phenoxy]propyl]-3-methyl-1,2-oxazole
  • 5-[3-[2,6-dimethyl-4-(2-methyl-4-oxazolyl)phenoxy]propyl]-3-methylisoxazole
  • 5-[3-[2,6-dimethyl-4-(2-methyloxazol-4-yl)phenoxy]propyl]-3-methyl-isoxazole
  • w03
  • win 65099
  • win65099
InChIKey SLPKYEWAKMNCPT-UHFFFAOYSA-N
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