Gyrophoric Acid

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Properties Simple | Detailed

Formula C24H20O10
IUPAC Name 4-[4-(2,4-dihydroxy-6-methyl-benzoyl)oxy-2-hydroxy-6-methyl-benzoyl]oxy-2-hydroxy-6-methyl-benzoic acid
Molecular Mass 468.410 g·mol−1
Heat of Formation 750.2 ± 16.7 kJ·mol−1
Dipole Moment 5.52 ± 1.08 D
Volume 469.8 Å 3
Surface Area 413.5 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy -0.69 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[4-(2,4-dihydroxy-6-methyl-benzoyl)oxy-2-hydroxy-6-methyl-benzoyl]oxy-2-hydroxy-6-methyl-benzoic acid
  • 4-[4-(2,4-dihydroxy-6-methyl-phenyl)carbonyloxy-2-hydroxy-6-methyl-phenyl]carbonyloxy-2-hydroxy-6-methyl-benzoic acid
  • 4-[[4-[(2,4-dihydroxy-6-methylphenyl)-oxomethoxy]-2-hydroxy-6-methylphenyl]-oxomethoxy]-2-hydroxy-6-methylbenzoic acid
  • benzoic acid, 4-((2,4-dihydroxy-6-methylbenzoyl)oxy)-2-hydroxy-6-methyl-, 4-carboxy-3-hydroxy-5-methylphenyl ester
  • stock1n-37646
CAS Number(s)
  • 548-89-0
InChIKey ATQPZSQVWCPVGV-UHFFFAOYSA-N
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