Guaiol

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Properties Simple | Detailed

Formula C15H26O
IUPAC Name 2-[(3s,5r,8s)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-ol
Molecular Mass 222.366 g·mol−1
Heat of Formation -374.5 ± 16.7 kJ·mol−1
Dipole Moment 1.66 ± 1.08 D
Volume 316.65 Å 3
Surface Area 265.6 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy 4.41 ± eV
Point Group Symmetry C1
Synonyms
  • (−)-guaiol
  • (3r,6s,10s)-6,10,alpha,alpha-tetramethylbicyclo[5.3.0]dec-1(7)-ene-3-methanol
  • 5-azulenemethanol, 1,2,3,4,5,6,7,8-octahydro-.alpha.,.alpha.,3,8-tetramethyl-, [3s-(3.alpha.,5.alpha.,8.alpha.)]-
  • [3s-(3alpha,5alpha,8alpha)]-1,2,3,4,5,6,7,8-octahydro-alpha,alpha,3,8-tetramethyl-5-azulenemethanol
  • champaca camphor
  • champacol
  • guai-1(5)-en-11-ol
  • guaiac alcohol
CAS Number(s)
  • 489-86-1
InChIKey TWVJWDMOZJXUID-SDDRHHMPSA-N
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