5-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-3',6'-Dihydroxy-3H-Spiro[2-Benzofuran-1,9'-Xanthen]-3-One

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Properties Simple | Detailed

Formula C23H12Cl2N4O5
IUPAC Name 6-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-3',6'-dihydroxy-spiro[isobenzofuran-3,9'-xanthene]-1-one
Molecular Mass 495.271 g·mol−1
Heat of Formation -316.5 ± 16.7 kJ·mol−1
Dipole Moment 6.67 ± 1.08 D
Volume 496.54 Å 3
Surface Area 432.35 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy -1.47 ± eV
Point Group Symmetry C1
Synonyms
  • 5-((4,6-dichloro-1,3,5-triazin-2-yl)amino)fluorescein
  • 6-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-3',6'-dihydroxy-1-spiro[isobenzofuran-3,9'-xanthene]one
  • 6-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-3',6'-dihydroxy-spiro[2-benzofuran-3,9'-xanthene]-1-one
  • 6-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one
  • 6-[(4,6-dichloro-s-triazin-2-yl)amino]-3',6'-dihydroxy-spiro[isobenzofuran-3,9'-xanthene]-1-one
  • spiro(isobenzofuran-1(3h),9'-(9h)xanthen)-3-one, 5-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-3',6'-dihydroxy-
CAS Number(s)
  • 68425-77-4
  • 93265-91-9
  • 102417-95-8
InChIKey HWQQCFPHXPNXHC-UHFFFAOYSA-N
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