Ilimaquinone

Molecule SVG Image

Properties Simple | Detailed

Formula C22H30O4
IUPAC Name 3-[[(1r,2s,4as,8as)-1,2,4a-trimethyl-5-methylene-decalin-1-yl]methyl]-2-hydroxy-5-methoxy-1,4-benzoquinone
Molecular Mass 358.471 g·mol−1
Heat of Formation -616.6 ± 16.7 kJ·mol−1
Dipole Moment 4.48 ± 1.08 D
Volume 441.3 Å 3
Surface Area 327.89 Å 2
HOMO Energy -9.67 ± 0.55 eV
LUMO Energy -1.45 ± eV
Point Group Symmetry C1
Synonyms
  • 2,5-cyclohexadiene-1,4-dione, 3-((decahydro-1,2,4a-trimethyl-5-methylene-1-naphthalenyl)methyl)-2-hydroxy-5-methoxy-, (1r-(1alpha,2beta,4abeta,8aalpha))-
  • 3-[(decahydro-1beta,2beta,4abeta-trimethyl-5-methylene-1-naphthyl)methyl]-2-hydroxy-5-methoxybenzoquinone
  • 3-[(decahydro-1beta,2beta,4abeta-trimethyl-5-methylene-1-napthyl)methyl]-2-hydroxy-5-methoxybenzoquinone
  • 3-[[(1r,2s,4as,8as)-1,2,4a-trimethyl-5-methylene-1-decalinyl]methyl]-2-hydroxy-5-methoxy-1,4-benzoquinone
  • 3-[[(1r,2s,4as,8as)-1,2,4a-trimethyl-5-methylene-decalin-1-yl]methyl]-2-hydroxy-5-methoxy-1,4-benzoquinone
  • 3-[[(1r,2s,4as,8as)-1,2,4a-trimethyl-5-methylene-decalin-1-yl]methyl]-2-hydroxy-5-methoxy-p-benzoquinone
  • 3-[[(1r,2s,4as,8as)-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2h-naphthalen-1-yl]methyl]-2-hydroxy-5-methoxy-cyclohexa-2,5-diene-1,4-dione
  • 3-[[(1r,2s,4as,8as)-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2h-naphthalen-1-yl]methyl]-2-hydroxy-5-methoxycyclohexa-2,5-diene-1,4-dione
  • illimaquinone
  • imaquinone
  • smp2_000173
CAS Number(s)
  • 71678-03-0
InChIKey JJWITJNSXCXULM-YVUMSICPSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O