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

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Properties Simple | Detailed

Formula C18H20Cl2N2O3
IUPAC Name 5-[5-[2,6-dichloro-4-(4,5-dihydrooxazol-2-yl)phenoxy]pentyl]-3-methyl-isoxazole
Molecular Mass 383.269 g·mol−1
Heat of Formation -244.0 ± 16.7 kJ·mol−1
Dipole Moment 5.24 ± 1.08 D
Volume 432.8 Å 3
Surface Area 401.33 Å 2
HOMO Energy -9.73 ± 0.55 eV
LUMO Energy -1.11 ± eV
Point Group Symmetry C1
Synonyms
  • 5-(5-(2,6-dichloro-4-(4,5-dihydro-2-oxazoly)phenoxy)pentyl)-3-methylisoxazole
  • 5-[5-[2,6-dichloro-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]pentyl]-3-methyl-1,2-oxazole
  • 5-[5-[2,6-dichloro-4-(4,5-dihydrooxazol-2-yl)phenoxy]pentyl]-3-methylisoxazole
  • isoxazole, 5-(5-(2,6-dichloro-4-(4,5-dihydro-2-oxazolyl)phenoxy)pentyl)-3-methyl-
  • win 54954
  • win-54954
  • win54954
CAS Number(s)
  • 107355-45-3
InChIKey JJDHAOLOHQTGMG-UHFFFAOYSA-N
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Elements H C N O Cl