(9As)-8-Acetyl-1,3,7-Trihydroxy-9A-Methyl-9-Oxo-9,9A-Dihydrodibenzo[B,D]Furan-4-Carboxamide

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Properties Simple | Detailed

Formula C16H13NO7
IUPAC Name (9as)-8-acetyl-1,3,7-trihydroxy-9a-methyl-9-oxo-dibenzofuran-4-carboxamide
Molecular Mass 331.277 g·mol−1
Heat of Formation -1016.8 ± 16.7 kJ·mol−1
Dipole Moment 3.99 ± 1.08 D
Volume 346.87 Å 3
Surface Area 303.51 Å 2
HOMO Energy -9.77 ± 0.55 eV
LUMO Energy 1.50 ± eV
Point Group Symmetry C1
Synonyms
  • (9as)-8-acetyl-1,3,7-trihydroxy-9-keto-9a-methyl-dibenzofuran-4-carboxamide
  • (9as)-8-acetyl-1,3,7-trihydroxy-9a-methyl-9-oxo-4-dibenzofurancarboxamide
  • (9as)-8-acetyl-1,3,7-trihydroxy-9a-methyl-9-oxo-dibenzofuran-4-carboxamide
  • (9as)-8-ethanoyl-1,3,7-trihydroxy-9a-methyl-9-oxo-dibenzofuran-4-carboxamide
  • 4-dibenzofurancarboxamide, 8-acetyl-9,9a-dihydro-1,3,7-trihydroxy-9a-methyl-9-oxo-, (s)-
  • cercosporamide
CAS Number(s)
  • 131436-22-1
InChIKey GEWLYFZWVLXQME-MRXNPFEDSA-N
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