Arenarone

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Properties Simple | Detailed

Formula C21H28O2
IUPAC Name 2-[[(1s,2r,4as,8ar)-1,2,4a-trimethyl-5-methylene-decalin-1-yl]methyl]-1,4-benzoquinone
Molecular Mass 312.446 g·mol−1
Heat of Formation -245.6 ± 16.7 kJ·mol−1
Dipole Moment 2.52 ± 1.08 D
Volume 400.88 Å 3
Surface Area 317.84 Å 2
HOMO Energy -9.65 ± 0.55 eV
LUMO Energy 1.31 ± eV
Point Group Symmetry C1
Synonyms
  • 2-((1s,2r,4as,8ar)-1,2,4a-trimethyl-5-methylene-decahydro-naphthalen-1-ylmethyl)-[1,4]benzoquinone
  • 2-[[(1s,2r,4as,8ar)-1,2,4a-trimethyl-5-methylene-1-decalinyl]methyl]-1,4-benzoquinone
  • 2-[[(1s,2r,4as,8ar)-1,2,4a-trimethyl-5-methylene-decalin-1-yl]methyl]-1,4-benzoquinone
  • 2-[[(1s,2r,4as,8ar)-1,2,4a-trimethyl-5-methylene-decalin-1-yl]methyl]-p-benzoquinone
  • 2-[[(1s,2r,4as,8ar)-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2h-naphthalen-1-yl]methyl]cyclohexa-2,5-diene-1,4-dione
InChIKey NXIFNLNXFPAWTO-QAJUQPOASA-N
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