3-[3,5-Dibromo-4-(4-Hydroxy-3-Isopropylphenoxy)Phenyl]Propanoic Acid

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Properties Simple | Detailed

Formula C18H18Br2O4
IUPAC Name 3-[3,5-dibromo-4-(4-hydroxy-3-isopropyl-phenoxy)phenyl]propanoic acid
Molecular Mass 458.141 g·mol−1
Heat of Formation -601.9 ± 16.7 kJ·mol−1
Dipole Moment 1.75 ± 1.08 D
Volume 431.46 Å 3
Surface Area 357.25 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy -1.11 ± eV
Point Group Symmetry C1
Synonyms
  • 3-[3,5-dibromo-4-(4-hydroxy-3-isopropyl-phenoxy)phenyl]propionic acid
  • 3-[3,5-dibromo-4-(4-hydroxy-3-propan-2-yl-phenoxy)phenyl]propanoic acid
  • oef
InChIKey DGODJDXDANWOEP-UHFFFAOYSA-N
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Elements H C O Br