Phylloquinone

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Properties Simple | Detailed

Formula C31H46O2
IUPAC Name 2-methyl-3-[(e,7r,11r)-3,7,11,15-tetramethylhexadec-2-enyl]naphthalene-1,4-dione
Molecular Mass 450.696 g·mol−1
Heat of Formation -496.6 ± 16.7 kJ·mol−1
Dipole Moment 2.52 ± 1.08 D
Volume 641.5 Å 3
Surface Area 540.78 Å 2
HOMO Energy -9.40 ± 0.55 eV
LUMO Energy 1.57 ± eV
Point Group Symmetry C1
Synonyms
  • 2-methyl-3-[(2e,7r,11r)-3,7,11,15-tetramethylhexadec-2-en-1-yl]naphthalene-1,4-dione
  • 2-methyl-3-[(e,7r,11r)-3,7,11,15-tetramethylhexadec-2-enyl]-1,4-naphthoquinone
  • phylloquinone (k1)
  • phytonadione, k1
  • pqn
  • vitamin k
  • vitamin- k1
  • vitamin- k1(20)
InChIKey MBWXNTAXLNYFJB-NKFFZRIASA-N
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Elements H C O