3-[4-(4-Hydroxyphenoxy)-3,5-Diiodophenyl]Propanoic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C15H12I2O4
IUPAC Name 3-[4-(4-hydroxyphenoxy)-3,5-diiodo-phenyl]propanoic acid
Molecular Mass 510.062 g·mol−1
Heat of Formation -401.7 ± 16.7 kJ·mol−1
Dipole Moment 1.14 ± 1.08 D
Volume 387.34 Å 3
Surface Area 336.86 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy -0.81 ± eV
Point Group Symmetry C1
Synonyms
  • 3,5-diiodothyropropionic acid
  • 3,5-ditpa
  • 3-[4-(4-hydroxyphenoxy)-3,5-diiodo-phenyl]propionic acid
  • benzenepropanoic acid, 4-(4-hydroxyphenoxy)-3,5-diiodo-
  • ditpa
CAS Number(s)
  • 1158-10-7
InChIKey WONYMNWUJVKVII-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements I H C O