4-Amino-3',6'-Dihydroxy-3H-Spiro[2-Benzofuran-1,9'-Xanthen]-3-One

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Properties Simple | Detailed

Formula C20H13NO5
IUPAC Name 7-amino-3',6'-dihydroxy-spiro[isobenzofuran-3,9'-xanthene]-1-one
Molecular Mass 347.321 g·mol−1
Heat of Formation -537.5 ± 16.7 kJ·mol−1
Dipole Moment 4.38 ± 1.08 D
Volume 370.6 Å 3
Surface Area 323.99 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy -0.62 ± eV
Point Group Symmetry C1
Synonyms
  • 7-amino-3',6'-dihydroxy-1-spiro[isobenzofuran-3,9'-xanthene]one
  • 7-amino-3',6'-dihydroxy-spiro[2-benzofuran-3,9'-xanthene]-1-one
  • 7-amino-3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one
  • spiro(isobenzofuran-1(3h),9'-(9h)xanthen)-3-one, 4-amino-3',6'-dihydroxy-
CAS Number(s)
  • 3326-33-8
InChIKey QLCDVUAIWJCGRU-UHFFFAOYSA-N
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