2-[(2E,7R,11R)-3,7,11,15-Tetramethyl-2-Hexadecen-1-Yl]-3-(Trifluoromethyl)-1,4-Naphthoquinone

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Formula C31H43F3O2
IUPAC Name 2-[(e,7r,11r)-3,7,11,15-tetramethylhexadec-2-enyl]-3-(trifluoromethyl)naphthalene-1,4-dione
Molecular Mass 504.667 g·mol−1
Heat of Formation -1156.3 ± 16.7 kJ·mol−1
Dipole Moment 5.41 ± 1.08 D
Volume 661.42 Å 3
Surface Area 446.07 Å 2
HOMO Energy -9.73 ± 0.55 eV
LUMO Energy -1.86 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[(e,7r,11r)-3,7,11,15-tetramethylhexadec-2-enyl]-3-(trifluoromethyl)-1,4-naphthoquinone
  • 2-[(e,7r,11r)-3,7,11,15-tetramethylhexadec-2-enyl]-3-(trifluoromethyl)naphthalene-1,4-dione
  • 2-trifluoromethyl-3-phytyl-1,4-naphthoquinone
  • 2-trifluoromethylphylloquinone
  • 2-trifluoromethylphytonadione
CAS Number(s)
  • 119052-95-8
InChIKey FFWJVWFHORVNTD-OLOZJIBXSA-N
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