Dimethyl 3,3'-Oxybis(6-Hydroxybenzoate)

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Properties Simple | Detailed

Formula C16H14O7
IUPAC Name methyl 2-hydroxy-5-(4-hydroxy-3-methoxycarbonyl-phenoxy)benzoate
Molecular Mass 318.278 g·mol−1
Heat of Formation -980.7 ± 16.7 kJ·mol−1
Dipole Moment 1.72 ± 1.08 D
Volume 353.38 Å 3
Surface Area 324.04 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy -0.83 ± eV
Point Group Symmetry C2
Synonyms
  • 2-hydroxy-5-(4-hydroxy-3-methoxycarbonylphenoxy)benzoic acid methyl ester
  • 5-(3-carbomethoxy-4-hydroxy-phenoxy)-2-hydroxy-benzoic acid methyl ester
  • benzoic acid, 3,3'-oxybis(6-hydroxy-, dimethyl ester
  • cylindol b
  • methyl 2-hydroxy-5-(4-hydroxy-3-methoxycarbonylphenoxy)benzoate
CAS Number(s)
  • 159225-90-8
InChIKey VSXYXFKPDHKDNT-UHFFFAOYSA-N
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