1-(3,4,5-Trihydroxyphenyl)-1-Nonanone

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Properties Simple | Detailed

Formula C15H22O4
IUPAC Name 1-(3,4,5-trihydroxyphenyl)nonan-1-one
Molecular Mass 266.333 g·mol−1
Heat of Formation -770.8 ± 16.7 kJ·mol−1
Dipole Moment 4.36 ± 1.08 D
Volume 342.21 Å 3
Surface Area 327.63 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy -0.41 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2,3-benzenetriol, 4-(octylcarbonyl)-
  • 1-(2,4,6-trihydroxyphenyl)-1-nonanone
  • 1-nonanone, 1-(2,4,6-trihydroxyphenyl)-
CAS Number(s)
  • 100079-26-3
InChIKey NVFRHTFJDGAFQS-UHFFFAOYSA-N
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