(2E)-2-[(3-Chlorophenyl)Hydrazono]-3-[5-(2-Methyl-2-Propanyl)-1,2-Oxazol-3-Yl]-3-Oxopropanenitrile

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Properties Simple | Detailed

Formula C16H15ClN4O2
IUPAC Name (1e)-2-(5-tert-butylisoxazol-3-yl)-n-(3-chloroanilino)-2-oxo-acetimidoyl cyanide
Molecular Mass 330.769 g·mol−1
Heat of Formation 237.0 ± 16.7 kJ·mol−1
Dipole Moment 6.52 ± 1.08 D
Volume 388.03 Å 3
Surface Area 355.72 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy 1.67 ± eV
Point Group Symmetry C1
Synonyms
  • (2e)-3-(5-tert-butyl-1,2-oxazol-3-yl)-2-[(3-chlorophenyl)hydrazinylidene]-3-oxo-propanenitrile
  • (2e)-3-(5-tert-butyl-3-isoxazolyl)-2-[(3-chlorophenyl)hydrazono]-3-oxopropanenitrile
  • (2e)-3-(5-tert-butylisoxazol-3-yl)-2-[(3-chlorophenyl)hydrazono]-3-keto-propionitrile
  • 2-(5-tert-butyl-1,2-oxazol-3-yl)-n-[(3-chlorophenyl)amino]-2-oxoethanimidoyl cyanide
  • 2-(5-tert-butylisoxazol-3-yl)-n-[(3-chlorophenyl)amino]-2-oxo-acetimidoyl cyanide
  • 3-(5-tert-butyl-1,2-oxazol-3-yl)-2-[(3-chlorophenyl)hydrazinylidene]-3-oxo-propanenitrile
  • 3-(5-tert-butyl-3-isoxazolyl)-2-[(3-chlorophenyl)hydrazono]-3-oxopropanenitrile
  • 3-(5-tert-butylisoxazol-3-yl)-2-[(3-chlorophenyl)hydrazono]-3-keto-propionitrile
  • sr-01000639519-1
InChIKey DXEATJQGQHDURZ-DEDYPNTBSA-N
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