4-[(1S,2S,5S)-5-(Hydroxymethyl)-8-Methyl-3-Oxabicyclo[3.3.1]Non-7-En-2-Yl]Phenol

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Formula C16H20O3
IUPAC Name 4-[(1s,5s,8s)-5-(hydroxymethyl)-2-methyl-7-oxabicyclo[3.3.1]non-2-en-8-yl]phenol
Molecular Mass 260.328 g·mol−1
Heat of Formation -461.5 ± 16.7 kJ·mol−1
Dipole Moment 2.87 ± 1.08 D
Volume 320.22 Å 3
Surface Area 271.68 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy -0.11 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[(1s,4s,5s)-1-(hydroxymethyl)-6-methyl-3-oxabicyclo[3.3.1]non-6-en-4-yl]phenol
  • 4-[(1s,4s,5s)-6-methyl-1-methylol-3-oxabicyclo[3.3.1]non-6-en-4-yl]phenol
InChIKey XXIFNRNIQJKFLP-XHSDSOJGSA-N
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