Aurachin D

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Properties Simple | Detailed

Formula C25H33NO
IUPAC Name 2-methyl-3-[(2e,6e)-3,7,11-trimethyldodeca-2,6,10-trienyl]-1h-quinolin-4-one
Molecular Mass 363.536 g·mol−1
Heat of Formation -113.8 ± 16.7 kJ·mol−1
Dipole Moment 3.76 ± 1.08 D
Volume 500.3 Å 3
Surface Area 438.64 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy 2.56 ± eV
Point Group Symmetry C1
Synonyms
  • 2-methyl-3-(3,7,11-trimethyldodeca-2,6,10-trienyl)-1h-quinolin-4-one
  • 2-methyl-3-(3,7,11-trimethyldodeca-2,6,10-trienyl)-4-quinolone
  • 2-methyl-3-[(2e,6e)-3,7,11-trimethyldodeca-2,6,10-trienyl]-1h-quinolin-4-one
  • 2-methyl-3-[(2e,6e)-3,7,11-trimethyldodeca-2,6,10-trienyl]-4-quinolone
  • 4(1h)-quinolinone, 2-methyl-3-(3,7,11-trimethyl-2,6,10-dodecatrienyl)-
  • aurachin-d
CAS Number(s)
  • 108354-13-8
InChIKey JHMLNOXMSHURLQ-YEFHWUCQSA-N
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