Methyl 5-Hydroxy-2-[3-Hydroxy-2-(Methoxycarbonyl)-5-Methylphenoxy]-3-Methoxybenzoate

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Properties Simple | Detailed

Formula C18H18O8
IUPAC Name methyl 2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonyl-phenoxy)-4-methyl-benzoate
Molecular Mass 362.331 g·mol−1
Heat of Formation -1214.5 ± 16.7 kJ·mol−1
Dipole Moment 5.02 ± 1.08 D
Volume 410.79 Å 3
Surface Area 337.98 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy -0.71 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(2-carbomethoxy-4-hydroxy-6-methoxy-phenoxy)-6-hydroxy-4-methyl-benzoic acid methyl ester
  • 2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoic acid methyl ester
  • acon0_000931
  • acon1_000170
  • megxm0_000386
  • methyl 2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate
InChIKey KYDNOVLBVBYOSW-UHFFFAOYSA-N
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Elements H C O