Butyl 4-Hydroxy-3,5-Diiodobenzoate

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Properties Simple | Detailed

Formula C11H12I2O3
IUPAC Name butyl 4-hydroxy-3,5-diiodo-benzoate
Molecular Mass 446.020 g·mol−1
Heat of Formation -344.5 ± 16.7 kJ·mol−1
Dipole Moment 3.19 ± 1.08 D
Volume 320.3 Å 3
Surface Area 300.71 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy -0.99 ± eV
Point Group Symmetry C1
Synonyms
  • 4-hydroxy-3,5-diiodo-benzoic acid butyl ester
  • 4-hydroxy-3,5-diiodobenzoic acid butyl ester
  • benzoic acid, 4-hydroxy-3,5-diiodo-, butyl ester
  • benzoic acid, 4-hydroxy-3,5-diiodo-, butyl ester (8ci)(9ci)
  • butyl 3,5-diiodo-4-hydroxybenzoate
  • diobene
  • diobutil
CAS Number(s)
  • 51-38-7
InChIKey AKPGOBAFPMFHET-UHFFFAOYSA-N
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