2,2'-{1,2-Ethanediylbis[(5-Bromo-2-Hydroxybenzyl)Imino]}Diacetic Acid

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Properties Simple | Detailed

Formula C20H22Br2N2O6
IUPAC Name 2-[(5-bromo-2-hydroxy-phenyl)methyl-[2-[(5-bromo-2-hydroxy-phenyl)methyl-(carboxymethyl)amino]ethyl]amino]acetic acid
Molecular Mass 546.207 g·mol−1
Heat of Formation -864.1 ± 16.7 kJ·mol−1
Dipole Moment 3.48 ± 1.08 D
Volume 550.89 Å 3
Surface Area 425.69 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy -0.18 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[(5-bromo-2-hydroxy-benzyl)-[2-[(5-bromo-2-hydroxy-benzyl)-(carboxymethyl)amino]ethyl]amino]acetic acid
  • 2-[(5-bromo-2-hydroxy-phenyl)methyl-[2-[(5-bromo-2-hydroxy-phenyl)methyl-(carboxymethyl)amino]ethyl]amino]ethanoic acid
  • 2-[(5-bromo-2-hydroxyphenyl)methyl-[2-[(5-bromo-2-hydroxyphenyl)methyl-(carboxymethyl)amino]ethyl]amino]acetic acid
  • 5-br-hbed
  • n,n'-bis(5-bromo-2-hydroxybenzyl)ethylenediamine diacetic acid
CAS Number(s)
  • 92830-04-1
InChIKey CURVWFGANKHUBF-UHFFFAOYSA-N
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Elements H C O Br N