2-Amino-3-Oxo-3H-Phenoxazine-1,9-Dicarboxylic Acid

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Properties Simple | Detailed

Formula C14H16N2O6
IUPAC Name 8-amino-7-oxo-3,4-dihydro-2h-phenoxazine-1,2,3,4,4a,9a,10,10a-octaide-1,9-dicarboxylic acid
Molecular Mass 308.287 g·mol−1
Heat of Formation -672.5 ± 16.7 kJ·mol−1
Dipole Moment 2.34 ± 1.08 D
Volume 309.12 Å 3
Surface Area 278.37 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy -2.15 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-3-keto-phenoxazine-1,9-dicarboxylic acid
  • 2-amino-3-oxo-3h-phenoxazin-1,9-dicarboxylic acid
  • 2-amino-3-oxo-phenoxazine-1,9-dicarboxylic acid
  • 2-amino-3h-phenoxazin-one-1,9-dicarboxylic acid
  • 3h-phenoxazin-1,9-dicarboxylic acid, 2-amino-3-oxo-
  • cinnabarinic acid
  • cinnavalininate
CAS Number(s)
  • 606-59-7
InChIKey FSBKJYLVDRVPTK-UHFFFAOYSA-N
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