4-({Benzyl[3-(2-Quinolinylmethoxy)Phenyl]Amino}Methyl)Benzoic Acid

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Properties Simple | Detailed

Formula C31H26N2O3
IUPAC Name 4-[[n-benzyl-3-(2-quinolylmethoxy)anilino]methyl]benzoic acid
Molecular Mass 474.550 g·mol−1
Heat of Formation -55.4 ± 16.7 kJ·mol−1
Dipole Moment 1.79 ± 1.08 D
Volume 583.18 Å 3
Surface Area 410.56 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy -0.80 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[[benzyl-[3-(2-quinolylmethoxy)phenyl]amino]methyl]benzoic acid
  • 4-[[phenylmethyl-[3-(2-quinolylmethoxy)phenyl]amino]methyl]benzoic acid
  • 4-[[phenylmethyl-[3-(quinolin-2-ylmethoxy)phenyl]amino]methyl]benzoic acid
  • eth 603
  • eth 647
  • eth-603
CAS Number(s)
  • 133430-68-9
InChIKey HFCVANWDNMLKNT-UHFFFAOYSA-N
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