2-(2,7-Difluoro-6-Hydroxy-3-Oxo-3H-Xanthen-9-Yl)Benzoic Acid

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Formula C20H18F2O5
IUPAC Name 2-(2,7-difluoro-3-hydroxy-6-oxo-1,4-dihydroxanthene-1,2,3,4,4a,8a,9,9a-octaid-9-yl)benzoic acid
Molecular Mass 376.351 g·mol−1
Heat of Formation -845.0 ± 16.7 kJ·mol−1
Dipole Moment 5.82 ± 1.08 D
Volume 383.27 Å 3
Surface Area 328.07 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy -1.90 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(2,7-difluoro-3-hydroxy-6-keto-xanthen-9-yl)benzoic acid
  • 2-(2,7-difluoro-3-hydroxy-6-oxo-9-xanthenyl)benzoic acid
  • 2-(2,7-difluoro-3-hydroxy-6-oxo-xanthen-9-yl)benzoic acid
  • molmap_000040
InChIKey VGIRNWJSIRVFRT-UHFFFAOYSA-N
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