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

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Properties Simple | Detailed

Formula C18H21ClN2O3
IUPAC Name 5-[5-[2-chloro-4-(4,5-dihydrooxazol-2-yl)phenoxy]pentyl]-3-methyl-isoxazole
Molecular Mass 348.824 g·mol−1
Heat of Formation -217.3 ± 16.7 kJ·mol−1
Dipole Moment 3.73 ± 1.08 D
Volume 409.95 Å 3
Surface Area 387.52 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -0.58 ± eV
Point Group Symmetry C1
Synonyms
  • 5-(5-(6-chloro-4-(4,5-dihydro-2-oxazolyl)phenoxy)pentyl)-3-methyl isoxazole
  • 5-[5-[2-chloro-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]pentyl]-3-methyl-1,2-oxazole
  • 5-[5-[2-chloro-4-(4,5-dihydrooxazol-2-yl)phenoxy]pentyl]-3-methylisoxazole
  • compound vii
  • isoxazole, 5-(5-(2-chloro-4-(4,5-dihydro-2-oxazolyl)phenoxy)pentyl)-3-methyl-
  • isoxazole, 5-[5-[2-chloro-4-(4,5-dihydro-2-oxazolyl)phenoxy]pentyl]-3-methyl-
  • w33
  • win 53338
  • win-53338
CAS Number(s)
  • 98033-68-2
InChIKey FCSKOFQQCWLGMV-UHFFFAOYSA-N
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Elements H C N O Cl