8-Amino-2-[(2-Amino-5-Methylphenoxy)Methyl]-6-Methoxyquinoline-N,N,N',N'-Tetraacetic Acid

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Properties Simple | Detailed

Formula C26H27N3O10
IUPAC Name 2-[2-[[8-[bis(carboxymethyl)amino]-6-methoxy-2-quinolyl]methoxy]-n-(carboxymethyl)-4-methyl-anilino]acetic acid
Molecular Mass 541.507 g·mol−1
Heat of Formation -1513.3 ± 16.7 kJ·mol−1
Dipole Moment 4.17 ± 1.08 D
Volume 613.63 Å 3
Surface Area 461.91 Å 2
HOMO Energy -8.40 ± 0.55 eV
LUMO Energy 2.21 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[[2-[[2-(bis(carboxymethyl)amino)-5-methyl-phenoxy]methyl]-6-methoxy-8-quinolyl]-(carboxymethyl)amino]acetic acid
  • 2-[[2-[[2-(bis(carboxymethyl)amino)-5-methyl-phenoxy]methyl]-6-methoxy-quinolin-8-yl]-(carboxymethyl)amino]ethanoic acid
  • 2-[[2-[[2-(bis(carboxymethyl)amino)-5-methylphenoxy]methyl]-6-methoxy-8-quinolyl]-(carboxymethyl)amino]acetic acid
  • 2-[[2-[[2-(bis(carboxymethyl)amino)-5-methylphenoxy]methyl]-6-methoxyquinolin-8-yl]-(carboxymethyl)amino]acetic acid
  • glycine, n-(2-((8-(bis(carboxymethyl)amino)-6-methoxy-2-quinolinyl)methoxy)-4-methylphenyl)-n-(carboxymethyl)-
  • n-(2-((8-(bis(carboxymethyl)amino)-6-methoxy-2-quinolinyl)methoxy)-4-methylphenyl)-n-(carboxymethyl)glycine
  • quin 2
  • quin2
CAS Number(s)
  • 83014-44-2
InChIKey XCBWMEWFFNUFLV-UHFFFAOYSA-N
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