2-({3-[(3,5-Dibromo-2-Ethoxybenzyl)Amino]Propyl}Amino)-4-Quinolinol

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Properties Simple | Detailed

Formula C21H32Br2N3O2+
IUPAC Name 2-[3-[(3,5-dibromo-2-ethoxy-phenyl)methylamino]propylamino]-1,3,5,6,7,8-hexahydroquinoline-2,3,4a,5,6,7,8,8a-octaid-4-one
Molecular Mass 518.306 g·mol−1
Heat of Formation -41.5 ± 16.7 kJ·mol−1
Dipole Moment 9.26 ± 1.08 D
Volume 499.32 Å 3
Surface Area 449.7 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -0.76 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[3-[(3,5-dibromo-2-ethoxy-benzyl)amino]propylamino]-4-quinolone
  • 2-[3-[(3,5-dibromo-2-ethoxy-phenyl)methylamino]propylamino]-1h-quinolin-4-one
InChIKey IAGLKMDFSLVFID-UHFFFAOYSA-N
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Elements H C Br O N