5-(3-(2,6-Dichloro-4-(4,5-Dihydro-2-Oxazolyl)Phenoxy)Propyl)-3-Methylisoxazole

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Properties Simple | Detailed

Formula C16H16Cl2N2O3
IUPAC Name 5-[3-[2,6-dichloro-4-(4,5-dihydrooxazol-2-yl)phenoxy]propyl]-3-methyl-isoxazole
Molecular Mass 355.216 g·mol−1
Heat of Formation -198.2 ± 16.7 kJ·mol−1
Dipole Moment 3.76 ± 1.08 D
Volume 388.51 Å 3
Surface Area 360.36 Å 2
HOMO Energy -9.76 ± 0.55 eV
LUMO Energy -1.15 ± eV
Point Group Symmetry C1
Synonyms
  • 5-[3-[2,6-dichloro-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]propyl]-3-methyl-1,2-oxazole
  • 5-[3-[2,6-dichloro-4-(4,5-dihydrooxazol-2-yl)phenoxy]propyl]-3-methylisoxazole
  • 5-{3-[2,6-dichloro-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]propyl}-3-methylisoxazole
  • isoxazole, 5-(3-(2,6-dichloro-4-(4,5-dihydro-2-oxazolyl)phenoxy)propyl)-3-methyl-
  • win 56291
  • win-56291
  • win56291
CAS Number(s)
  • 107355-76-0
InChIKey TUGBWRGTMLOFAX-UHFFFAOYSA-N
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Elements H C N O Cl