8-Hydroxy-2H-1,3-Benzoxazine-2,4(3H)-Dione

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Properties Simple | Detailed

Formula C8H5NO4
IUPAC Name 8-hydroxy-1,3-benzoxazine-2,4-dione
Molecular Mass 179.130 g·mol−1
Heat of Formation -548.8 ± 16.7 kJ·mol−1
Dipole Moment 4.56 ± 1.08 D
Volume 181.86 Å 3
Surface Area 182.13 Å 2
HOMO Energy -9.63 ± 0.55 eV
LUMO Energy 1.71 ± eV
Point Group Symmetry Cs
Synonyms
  • 2h-1,3-benzoxazine-2,4(3h)-dione, 8-hydroxy-
  • 8-hydroxy-1,3-benzoxazine-2,4-quinone
  • benadrostin
CAS Number(s)
  • 117241-60-8
InChIKey BQIRLGRTNUTGAT-UHFFFAOYSA-N
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