5-(O-(2-(Dimethylamino)Ethoxy)Phenyl)-3-Phenyl-1,2,4-Oxadiazole.

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Properties Simple | Detailed

Formula C18H19N3O2
IUPAC Name n,n-dimethyl-2-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]ethanamine
Molecular Mass 309.362 g·mol−1
Heat of Formation 146.0 ± 16.7 kJ·mol−1
Dipole Moment 2.00 ± 1.08 D
Volume 380.16 Å 3
Surface Area 329.85 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy -0.59 ± eV
Point Group Symmetry C1
Synonyms
  • dimethyl-[2-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]ethyl]amine
  • irampanel
  • n,n-dimethyl-2-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]ethanamine
CAS Number(s)
  • 206260-33-5
InChIKey QZULPCPLWGCGSL-UHFFFAOYSA-N
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