N-Allyl-1-Oxo-4-Phenyl-1H-Isochromene-3-Carboxamide

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Properties Simple | Detailed

Formula C19H15NO3
IUPAC Name n-allyl-1-oxo-4-phenyl-isochromene-3-carboxamide
Molecular Mass 305.327 g·mol−1
Heat of Formation -164.5 ± 16.7 kJ·mol−1
Dipole Moment 5.65 ± 1.08 D
Volume 364.92 Å 3
Surface Area 305.85 Å 2
HOMO Energy -9.26 ± 0.55 eV
LUMO Energy -1.01 ± eV
Point Group Symmetry C1
Synonyms
  • 1-oxo-4-phenyl-n-prop-2-enyl-isochromene-3-carboxamide
  • 1h-2-benzopyran-3-carboxamide, 1-oxo-4-phenyl-n-2-propenyl-
  • 4-phenyl-3-isocoumarinic acid allylamide
  • n-allyl-1-keto-4-phenyl-isochromene-3-carboxamide
  • n-allyl-1-oxo-4-phenyl-3-isochromenecarboxamide
  • n-allyl-1-oxo-4-phenyl-isochromene-3-carboxamide
CAS Number(s)
  • 41571-18-0
InChIKey LGQYYNUZQIHVPC-UHFFFAOYSA-N
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