1-{8-Methoxy-4-[(2-Methylphenyl)Amino]-3-Quinolinyl}-1-Butanone

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Properties Simple | Detailed

Formula C21H22N2O2
IUPAC Name 1-[8-methoxy-4-(2-methylanilino)-3-quinolyl]butan-1-one
Molecular Mass 334.412 g·mol−1
Heat of Formation -113.2 ± 16.7 kJ·mol−1
Dipole Moment 1.40 ± 1.08 D
Volume 408.23 Å 3
Surface Area 350.06 Å 2
HOMO Energy -8.24 ± 0.55 eV
LUMO Energy -0.91 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[8-methoxy-4-[(2-methylphenyl)amino]-3-quinolyl]butan-1-one
  • 1-[8-methoxy-4-[(2-methylphenyl)amino]quinolin-3-yl]butan-1-one
  • 1-butanone, 1-(8-methoxy-4-((2-methylphenyl)amino)-3-quinolinyl)-
  • 3-butyryl-4-(2-methylphenylamino)-8-methoxyquinoline
  • sk&f 96067
  • sk&f-96067
  • skf-96067
CAS Number(s)
  • 115607-61-9
InChIKey MAVJDLHBPIXVJL-UHFFFAOYSA-N
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