4-({2-Hydroxy-4-[(4-Hydroxy-2-Methoxy-3,5,6-Trimethylbenzoyl)Oxy]-3,5,6-Trimethylbenzoyl}Oxy)-2-Methoxy-3,5,6-Trimethylbenzoic Acid

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Properties Simple | Detailed

Formula C32H36O10
IUPAC Name 4-[2-hydroxy-4-(4-hydroxy-2-methoxy-3,5,6-trimethyl-benzoyl)oxy-3,5,6-trimethyl-benzoyl]oxy-2-methoxy-3,5,6-trimethyl-benzoic acid
Molecular Mass 580.622 g·mol−1
Heat of Formation -1721.1 ± 16.7 kJ·mol−1
Dipole Moment 9.40 ± 1.08 D
Volume 680.92 Å 3
Surface Area 543.25 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy -0.54 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[2-hydroxy-4-(4-hydroxy-2-methoxy-3,5,6-trimethyl-phenyl)carbonyloxy-3,5,6-trimethyl-phenyl]carbonyloxy-2-methoxy-3,5,6-trimethyl-benzoic acid
  • 4-[2-hydroxy-4-(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid
  • 4-[[2-hydroxy-4-[(4-hydroxy-2-methoxy-3,5,6-trimethylphenyl)-oxomethoxy]-3,5,6-trimethylphenyl]-oxomethoxy]-2-methoxy-3,5,6-trimethylbenzoic acid
  • benzoic acid, 2-hydroxy-4-((4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy)-3,5,6-trimethyl-, 4-carboxy-3-methoxy-2,5,6-trimethylphenyl ester
  • benzoic acid, 2-hydroxy-4-((4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy)-3,5,6-trimethyl-,4-carboxy-3-methoxy-2,5,6-trimethylphenyl ester
  • ps 990
  • ps-990
CAS Number(s)
  • 158792-23-5
InChIKey UESGSZFVMHDIFM-UHFFFAOYSA-N
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